data_1tmw_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 1tmw _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.628 0.251 . . . . 0.0 110.517 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -138.82 151.26 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -113.22 127.85 70.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.954 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -80.44 108.91 14.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.52 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -37.38 86.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.209 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -62.76 -54.01 45.61 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.201 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.47 ' HB3' ' HD2' ' A' ' 38' ' ' PRO . . . -61.97 -51.84 66.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.163 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 m -54.45 -43.04 71.29 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.881 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -67.73 -42.43 81.9 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.799 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.96 -51.95 64.55 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.98 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.54 -42.35 98.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.926 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.32 -45.22 80.43 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.844 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -57.67 -42.9 84.54 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.092 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -44.79 91.6 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.888 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.2 t -62.93 -33.87 63.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -60.12 -34.79 74.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 C--O 1.233 0.229 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.567 179.418 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.211 0 CA-C-O 120.955 0.407 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.4 t -140.76 122.9 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.683 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -126.18 -39.41 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 35.9 p-90 -117.44 154.88 30.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.479 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 16.3 m -141.73 146.68 22.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.081 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.428 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 0.2 OUTLIER -88.17 168.59 12.63 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.221 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -148.39 100.77 3.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.283 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.48 155.13 50.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.687 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.8 p90 -106.03 133.2 51.13 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.017 0.437 . . . . 0.0 111.498 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -108.8 120.3 42.08 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.193 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.34 -74.56 1.68 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.227 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.6 37.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.779 0.323 . . . . 0.0 111.227 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.1 t -154.22 131.77 11.36 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.812 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.0 mt -78.0 138.65 19.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.466 HG22 ' HB3' ' A' ' 9' ' ' ALA . 7.1 p -153.6 140.33 12.9 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 9' ' ' ALA . 16.6 Cg_endo -57.12 161.83 10.36 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.603 2.202 . . . . 0.0 112.292 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.428 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.64 -151.26 7.23 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.632 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.0 mp0 -34.73 140.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.619 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -137.78 97.77 3.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.357 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.79 165.64 25.83 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.598 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.06 -23.14 33.29 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.643 0.258 . . . . 0.0 110.671 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -86.47 106.97 17.85 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.824 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -68.76 -21.08 64.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.525 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -48.04 -38.38 17.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.816 0.341 . . . . 0.0 110.675 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.67 -40.62 95.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.23 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 60' ' ' ALA . 48.1 t80 -65.52 -43.6 89.55 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.142 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 6.4 mt -59.72 -42.88 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.361 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.11 -37.81 69.43 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.608 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -38.94 67.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.385 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.418 ' SG ' HD13 ' A' ' 58' ' ' LEU . 5.6 m -86.69 80.4 8.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.637 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.52 161.75 13.47 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.436 ' HA ' ' CA ' ' A' ' 83' ' ' GLY . 3.1 p-10 -72.84 69.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 111.218 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.752 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.0 OUTLIER -168.07 41.17 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.427 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.48 ' O ' ' N ' ' A' ' 83' ' ' GLY . 0.0 OUTLIER 174.97 -172.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.587 -179.335 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.5 122.77 9.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.632 0.253 . . . . 0.0 110.525 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.418 HD13 ' SG ' ' A' ' 52' ' ' CYS . 3.0 pp -153.84 174.05 15.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.048 0.451 . . . . 0.0 111.673 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -107.46 171.75 7.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.691 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.422 ' HB3' ' CE2' ' A' ' 48' ' ' PHE . . . -155.3 162.33 40.89 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.425 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -150.15 107.17 3.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.778 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.9 t -126.18 136.18 61.58 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.028 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -109.84 136.51 49.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.605 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -121.8 144.82 48.59 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.347 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.856 0.36 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 136.93 11.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.738 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -84.12 152.64 24.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.427 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -151.29 116.11 5.2 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.81 110.38 22.76 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.489 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.6 mp -104.79 126.24 59.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.329 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.9 106.9 16.64 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.35 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -91.88 132.95 36.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.25 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.6 pt -138.52 84.76 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.023 0.44 . . . . 0.0 111.517 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.48 ' N ' ' O ' ' A' ' 56' ' ' VAL . . . -59.12 130.93 51.52 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.974 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.462 ' C ' ' H ' ' A' ' 86' ' ' VAL . 12.5 mt-10 -30.35 -30.91 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.752 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -75.28 36.64 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.565 0.62 . . . . 0.0 111.719 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.462 ' H ' ' C ' ' A' ' 84' ' ' GLU . 98.1 t -88.61 107.46 17.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.293 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -65.26 165.3 11.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.806 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.38 -47.47 50.71 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.918 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -42.63 99.13 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.598 0.237 . . . . 0.0 110.981 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.459 ' HB3' HG13 ' A' ' 86' ' ' VAL . 2.2 mp0 -70.67 -35.1 72.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.073 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -57.08 -53.69 55.19 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.606 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.87 73.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -61.01 -36.69 80.17 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.102 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.6 m -55.64 -52.3 64.29 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.44 0.162 . . . . 0.0 111.006 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.63 -43.89 98.67 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.339 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.4 m -63.35 -47.41 82.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.77 0.319 . . . . 0.0 110.642 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.58 -37.47 81.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.272 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -32.23 70.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.754 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.0 m -72.35 -41.55 66.33 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.461 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.7 mt -60.13 -50.19 74.67 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 26.4 t -64.33 -36.81 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.0 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.17 -44.82 71.82 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -38.52 70.42 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.749 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.6 t -58.84 -45.96 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.799 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' A' ' 108' ' ' PHE . 39.7 t -96.21 96.18 5.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.62 -33.18 53.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.424 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -111.13 95.97 5.86 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.401 ' HB3' HG12 ' A' ' 105' ' ' VAL . 23.2 p90 -126.04 178.36 5.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.111 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.19 -54.9 1.99 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.214 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -151.05 132.04 14.26 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.801 0.334 . . . . 0.0 111.452 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -136.6 125.24 23.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.508 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -152.17 161.95 41.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.009 0.433 . . . . 0.0 111.436 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 22.8 t -93.35 149.25 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 42.7 mt -137.19 140.58 42.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.71 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 18.1 p -128.34 23.53 5.95 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.358 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -143.77 137.58 28.17 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.7 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.52 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 6.6 ttp180 -61.74 -37.02 82.68 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.329 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -70.74 -33.64 71.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.404 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.415 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 8.6 mt-10 -76.8 -30.61 56.5 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.078 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.52 ' CD2' ' HA ' ' A' ' 117' ' ' ARG . 2.6 pp -88.58 -7.41 56.49 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.207 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -54.5 152.64 6.46 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.171 0.51 . . . . 0.0 110.76 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -55.45 -42.28 74.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.27 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -31.0 72.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.697 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.415 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 11.8 t80 -75.5 -46.21 33.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.97 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 22.9 mt -58.96 -53.58 45.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -58.59 -35.27 72.14 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.5 t -60.47 -48.0 83.69 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.655 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.53 -41.72 95.03 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.93 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.0 mt -68.39 -43.42 77.31 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.244 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 12.7 tptm . . . . . 0 C--O 1.232 0.151 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.385 -179.616 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.711 0.291 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -111.87 145.13 40.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.139 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 16.2 tt -110.59 127.59 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.78 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -87.31 115.62 24.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.603 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -70.77 -45.29 65.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.287 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -59.46 -42.77 92.77 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.242 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.03 -56.09 11.57 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.893 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.5 t -55.47 -42.92 74.99 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.877 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -44.89 93.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.863 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.16 -46.9 69.08 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.037 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.15 -32.35 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.309 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.03 -56.43 21.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.649 0.261 . . . . 0.0 111.473 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -68.69 -24.55 64.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.21 -39.58 22.89 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.568 0.223 . . . . 0.0 111.53 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.463 ' HA ' HG11 ' A' ' 24' ' ' VAL . 9.9 p -71.93 -32.94 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.419 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -67.81 -23.97 65.24 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.203 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.8 t70 . . . . . 0 C--O 1.235 0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.636 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB2' ' HB1' ' A' ' 43' ' ' ALA . . . . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.961 0.41 . . . . 0.0 110.507 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.463 HG11 ' HA ' ' A' ' 17' ' ' VAL . 45.8 t -137.35 112.84 10.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.5 pp -125.36 -31.54 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.976 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.405 ' CZ3' ' O ' ' A' ' 40' ' ' GLU . 34.6 p-90 -122.91 159.49 28.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.43 . . . . 0.0 111.421 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 6.5 m -138.08 144.86 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.176 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.412 ' O ' ' N ' ' A' ' 39' ' ' GLY . 1.5 p -103.75 97.06 7.13 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.558 -179.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.491 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 10.8 m-85 -78.62 110.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 0.0 110.948 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -126.63 175.34 8.02 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.311 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -82.13 128.27 33.97 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.439 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.8 OUTLIER -96.37 69.01 2.61 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.083 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -13.77 10.13 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.284 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 169.51 -31.9 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.956 0.378 . . . . 0.0 111.104 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -91.88 177.18 6.26 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.663 0.268 . . . . 0.0 110.854 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.07 123.01 68.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.018 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.439 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 28.8 m -147.26 154.65 46.1 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.192 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.491 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 37.1 Cg_endo -66.27 161.37 40.83 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.519 2.146 . . . . 0.0 112.174 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -132.7 -151.07 6.59 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.092 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.483 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.6 mp0 -27.46 133.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.32 0.648 . . . . 0.0 111.993 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.438 ' HB3' HG13 ' A' ' 24' ' ' VAL . 11.0 mt-30 -128.74 99.05 5.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.351 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.86 23.95 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.402 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 23' ' ' ALA . . . -86.74 -25.0 24.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 110.837 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.44 118.53 30.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.508 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.407 ' CE2' HG22 ' A' ' 49' ' ' ILE . 13.1 t80 -66.83 -19.6 65.77 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.646 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.02 -40.24 10.28 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.069 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -37.19 86.54 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.272 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -70.37 -49.76 45.83 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.313 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.407 HG22 ' CE2' ' A' ' 45' ' ' TYR . 20.2 pt -59.42 -23.51 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.556 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.27 -27.44 18.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.304 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.07 -33.91 33.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.747 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.4 p -66.29 81.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.037 0.446 . . . . 0.0 111.844 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -90.82 153.16 20.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -88.24 62.17 6.59 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.997 0.427 . . . . 0.0 111.299 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.556 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.1 t0 -158.85 29.94 0.22 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.231 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 173.87 158.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.846 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.487 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -106.44 143.7 34.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.465 179.156 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 pp -160.04 147.37 16.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.458 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -86.04 169.57 13.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.945 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 154.86 36.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.467 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -149.71 114.52 5.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.541 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 16.5 t -124.92 144.18 35.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.152 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 143.91 45.76 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.971 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -128.56 158.16 39.22 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.001 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.586 179.315 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.578 0.228 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm -119.49 162.97 17.99 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -132.53 131.67 41.82 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.816 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.422 ' CB ' HD13 ' A' ' 129' ' ' LEU . . . -130.24 121.05 25.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.169 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.36 100.14 10.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.257 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 12.3 mt -100.91 145.38 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.162 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.436 ' HB ' HG13 ' A' ' 113' ' ' VAL . 16.1 m -117.18 120.73 39.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.231 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -92.09 143.81 26.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.329 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 56.8 mt -139.56 111.1 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.129 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -89.44 107.4 3.4 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 113.376 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 7.56 -68.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 178.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.556 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 9.5 m-80 -42.38 -26.25 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.943 0.497 . . . . 0.0 111.925 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 74.3 t -54.06 100.19 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.291 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.7 p -75.33 -178.41 3.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.57 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.44 -47.72 62.06 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.184 -0.531 . . . . 0.0 112.639 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.1 mt -59.02 -46.59 87.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.714 0.293 . . . . 0.0 110.621 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.487 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 5.8 mp0 -65.59 -38.56 89.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.521 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -63.49 -39.61 94.89 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 -34.27 77.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.071 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -46.27 89.59 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -34.51 73.33 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.76 -51.68 54.0 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.966 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 m -64.34 -37.56 87.94 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.711 0.291 . . . . 0.0 110.665 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -60.56 -40.93 93.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.69 -32.11 68.84 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.574 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.8 m -69.42 -44.13 71.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.771 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.5 mt -62.07 -46.64 88.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.855 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.7 t -67.17 -33.36 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.165 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 ttpp -70.13 -38.39 75.53 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.955 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -30.67 69.22 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.9 p -92.7 -32.03 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.233 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 26.0 t -122.02 109.41 24.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.925 0.393 . . . . 0.0 110.867 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -18.53 13.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.762 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.04 79.66 2.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.764 0.316 . . . . 0.0 111.024 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -140.73 159.9 41.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.59 -55.17 2.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.45 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.7 150.05 51.52 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.777 0.322 . . . . 0.0 111.274 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.22 124.62 15.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.078 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -160.31 153.44 21.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.897 0.38 . . . . 0.0 111.366 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.436 HG13 ' HB ' ' A' ' 80' ' ' THR . 6.2 m -90.99 153.8 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.975 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 60.1 mt -139.56 142.18 33.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.928 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.21 25.87 3.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.383 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -139.14 139.39 37.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.888 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -67.21 -36.78 82.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.999 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -66.2 -45.37 81.01 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.548 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 -25.12 64.8 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.049 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.9 mt -73.56 -31.37 63.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.981 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -49.45 136.63 16.07 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.008 0.433 . . . . 0.0 111.385 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -31.08 7.28 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.143 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -59.74 -41.84 91.83 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 120.932 0.396 . . . . 0.0 110.261 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -76.78 -43.46 36.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.111 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 38.2 mm -60.53 -47.33 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.255 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -62.56 -32.84 73.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.3 t -68.91 -47.58 65.42 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.604 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -66.16 -39.94 90.17 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.135 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.422 HD13 ' CB ' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -61.57 -23.46 65.99 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.663 -179.937 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.1 tptm . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.612 0.244 . . . . 0.0 111.26 179.653 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.677 0.275 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -112.6 147.37 36.82 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.02 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.404 HG13 ' HB ' ' A' ' 36' ' ' ILE . 2.3 tt -109.42 126.98 66.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.52 107.96 13.76 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.509 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 2.2 mttt -63.03 -38.57 91.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.289 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.6 -52.44 65.41 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.143 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.532 ' HB3' ' HD2' ' A' ' 38' ' ' PRO . . . -63.14 -50.88 68.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.3 m -54.52 -43.43 71.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.117 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -61.35 -45.3 94.98 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.681 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.65 73.62 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.54 -52.01 67.01 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.963 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.23 -45.91 79.75 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.89 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -57.23 -46.22 83.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -43.35 83.99 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.062 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.1 t -65.84 -33.55 64.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.984 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -59.19 -38.91 81.01 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 C--O 1.233 0.206 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.309 179.363 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.338 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.8 t -133.85 125.74 49.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-O 120.579 0.228 . . . . 0.0 110.929 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.2 pp -113.07 -31.0 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.823 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.458 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.0 p-90 -127.86 157.66 39.88 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 110.968 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.2 m -140.46 144.78 26.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.723 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.419 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 98.0 m -88.28 161.42 17.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.696 0.284 . . . . 0.0 110.908 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -144.64 97.17 2.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.99 0.424 . . . . 0.0 110.518 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.86 -178.63 4.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.97 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -112.97 118.27 34.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.001 0.429 . . . . 0.0 111.275 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.75 111.45 23.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.192 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.7 -75.41 1.84 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.237 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.27 35.41 0.17 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 111.069 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 t -155.68 140.73 17.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.404 ' HB ' HG13 ' A' ' 5' ' ' ILE . 33.5 mm -70.61 137.35 24.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.811 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.485 HG22 ' HB3' ' A' ' 9' ' ' ALA . 7.6 p -160.27 139.87 8.2 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.996 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.532 ' HD2' ' HB3' ' A' ' 9' ' ' ALA . 12.9 Cg_endo -55.28 152.7 30.53 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.822 2.348 . . . . 0.0 112.16 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.419 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -124.62 -150.35 7.83 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.746 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.458 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 17.6 mp0 -32.05 136.25 0.07 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.651 0.781 . . . . 0.0 112.727 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -136.85 97.49 3.54 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.328 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.22 168.94 25.58 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.773 -0.727 . . . . 0.0 113.461 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.77 -20.07 23.97 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.708 0.289 . . . . 0.0 110.618 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -93.24 128.62 39.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.541 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -76.83 -21.29 55.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.787 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -38.55 19.92 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.962 0.41 . . . . 0.0 110.489 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -37.5 87.44 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.401 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -69.33 -48.78 60.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.22 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.441 HG21 HD13 ' A' ' 49' ' ' ILE . 52.0 mt -62.1 -38.98 82.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.357 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.99 -41.07 87.38 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.673 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -34.01 46.41 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.69 84.95 3.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.9 p -85.85 169.62 13.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.188 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -83.79 17.87 2.17 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.699 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -134.27 65.08 1.58 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.787 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 170.25 143.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.625 -179.608 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.79 125.84 54.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.631 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 pp -153.81 171.93 18.14 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.019 0.437 . . . . 0.0 111.503 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -104.9 167.16 9.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.54 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -153.8 155.32 35.61 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.641 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.484 ' CE1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -145.55 119.16 9.13 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.1 t -128.35 144.37 38.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.951 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 mmt85 -100.44 105.33 16.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.613 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 125' ' ' ILE . 28.5 m-85 -90.17 153.63 20.37 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.273 179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -143.17 149.89 38.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.02 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -106.39 118.83 37.66 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.417 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -129.53 119.23 23.35 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.251 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.5 ' HG ' ' HB3' ' A' ' 111' ' ' GLU . 0.5 OUTLIER -99.34 124.61 44.59 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.09 179.444 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mt -116.43 145.58 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.687 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -112.5 114.34 26.97 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.288 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -91.99 135.67 33.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.533 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mt -138.2 89.91 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.151 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.09 116.83 9.92 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.975 -0.631 . . . . 0.0 111.664 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.459 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.8 mt-10 -29.21 -40.31 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.699 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.4 m-80 -72.27 41.55 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.115 0.483 . . . . 0.0 111.985 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.459 ' H ' ' C ' ' A' ' 84' ' ' GLU . 20.1 t -107.71 122.76 62.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.11 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -72.4 164.45 26.33 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.85 0.357 . . . . 0.0 111.39 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.17 -44.32 57.2 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.022 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.33 -47.88 77.85 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.638 0.256 . . . . 0.0 110.896 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.21 -34.97 77.24 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.49 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -60.51 -45.18 94.73 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.89 87.59 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.776 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -53.25 -40.72 64.81 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.857 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 m -56.49 -41.92 77.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.173 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.95 -45.02 97.0 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.624 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -46.35 55.16 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.514 0.197 . . . . 0.0 111.251 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -64.11 -35.06 79.52 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.448 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -55.85 -36.66 67.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.877 0.37 . . . . 0.0 110.259 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.5 m -72.95 -42.15 63.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.279 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.78 -48.88 79.89 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.99 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 46.9 t -62.38 -46.29 96.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -36.9 76.64 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.947 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.38 -35.83 81.7 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.089 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 40.4 t -76.77 -42.92 33.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 36.9 t -119.97 108.56 23.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.032 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.73 -25.38 12.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.586 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -78.89 85.35 4.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.834 0.35 . . . . 0.0 110.782 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -133.24 177.41 7.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.002 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.91 -57.6 2.09 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.501 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -135.88 140.35 44.05 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.219 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.5 ' HB3' ' HG ' ' A' ' 78' ' ' LEU . 9.1 pt-20 -141.28 132.36 26.26 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.873 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -154.24 168.23 27.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.968 0.413 . . . . 0.0 111.63 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 23.0 t -106.9 145.29 14.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.028 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 84.5 mt -124.65 134.28 67.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.594 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -122.2 17.96 10.72 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.723 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -155.3 145.5 21.8 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 111.022 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -61.05 -28.68 69.24 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.497 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -59.93 -46.77 88.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.612 0.244 . . . . 0.0 110.561 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -66.63 -41.83 87.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.456 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 12.3 mt -53.36 -35.44 60.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.586 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -42.83 126.56 3.8 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.567 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.77 -37.89 44.88 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.007 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -59.24 -46.4 88.58 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.803 0.335 . . . . 0.0 110.619 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -61.41 -50.45 72.81 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.906 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 64' ' ' PHE . 32.6 mm -56.93 -45.76 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -48.32 74.53 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.348 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -62.87 -42.43 99.75 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.857 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -58.0 -50.91 71.8 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.018 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.25 -37.74 88.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.687 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.666 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.9 p . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.554 0.216 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -119.57 149.11 42.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.097 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 17.1 tt -132.5 131.0 60.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.84 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.07 105.59 13.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.878 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -60.27 -41.47 93.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -62.42 -43.6 98.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.468 ' HB3' HG22 ' A' ' 37' ' ' VAL . . . -64.88 -57.34 9.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.091 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 t -54.33 -43.58 71.34 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.871 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.95 -45.18 94.81 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.713 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.68 -50.36 68.42 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 -50.78 72.68 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.627 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -55.94 -43.14 77.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.037 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.451 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 68.0 m-20 -64.55 -33.79 76.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.793 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.63 -46.81 62.63 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.701 0.286 . . . . 0.0 111.15 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 t -68.34 -38.69 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.449 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 9.6 ptm180 -67.52 -23.9 65.5 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.939 0.399 . . . . 0.0 111.291 -179.777 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.306 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 67.7 t -143.22 117.8 4.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.845 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -108.11 -29.4 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.444 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 42.5 p-90 -129.78 159.62 35.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.966 0.412 . . . . 0.0 111.301 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.479 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -144.89 150.51 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.908 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.474 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 0.2 OUTLIER -91.06 162.57 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.027 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -148.18 101.6 3.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 pttt -132.23 159.71 38.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 35' ' ' THR . 54.3 p90 -116.01 131.79 56.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.74 103.04 14.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.849 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.84 -73.27 2.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.758 . . . . 0.0 111.734 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -155.45 32.81 0.37 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.724 0.297 . . . . 0.0 111.464 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.428 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 0.7 OUTLIER -140.5 117.56 11.19 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 11.2 mt -77.35 133.45 30.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.245 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.468 HG22 ' HB3' ' A' ' 9' ' ' ALA . 11.3 p -151.2 137.72 11.48 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.33 158.12 23.77 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.567 2.178 . . . . 0.0 112.639 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.474 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -127.12 -152.17 7.92 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.629 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 10.0 mp0 -35.48 140.81 0.09 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.536 0.734 . . . . 0.0 112.515 -179.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -139.03 98.2 3.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.56 167.56 24.74 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.26 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.449 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -85.41 -20.14 30.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.696 -0.252 . . . . 0.0 110.972 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -93.05 107.58 19.34 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.457 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.94 -21.17 65.11 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -46.34 -39.7 10.67 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.776 0.322 . . . . 0.0 110.631 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -42.55 94.94 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.409 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.407 ' O ' ' HB2' ' A' ' 52' ' ' CYS . 40.0 t80 -68.12 -42.41 80.25 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.878 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.01 -35.13 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.207 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.36 -37.25 25.91 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.694 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.98 -42.55 57.37 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -72.66 84.17 1.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.111 0.481 . . . . 0.0 111.049 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.05 164.48 22.44 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.563 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.4 38.5 0.83 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.777 0.323 . . . . 0.0 111.793 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.715 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -139.47 45.28 1.95 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.922 0.391 . . . . 0.0 111.336 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.423 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.48 157.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.812 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.31 134.91 45.91 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.325 179.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.9 mt -147.22 170.42 17.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.063 0.459 . . . . 0.0 111.965 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -119.68 160.5 22.41 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.118 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.81 153.44 29.79 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.897 0.379 . . . . 0.0 111.63 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -139.38 122.62 16.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.578 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.5 t -130.53 142.38 43.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.91 0.386 . . . . 0.0 111.628 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -101.92 118.47 36.99 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.717 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.444 ' HB2' HD22 ' A' ' 129' ' ' LEU . 58.2 m-85 -102.15 165.1 11.33 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.98 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.233 0.229 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.603 179.754 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.876 0.37 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -144.18 162.71 35.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.602 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.449 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 8.2 m-85 -106.35 153.85 21.62 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.795 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -154.65 125.94 7.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.633 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.3 tt -92.66 127.33 38.12 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.345 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.5 mt -122.02 107.94 20.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.603 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.2 m -97.33 132.01 43.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.007 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.416 ' CZ3' HD13 ' A' ' 120' ' ' LEU . 75.3 t-105 -114.13 141.84 46.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.871 0.367 . . . . 0.0 111.304 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.6 mt -137.27 104.11 3.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.42 124.12 6.37 Favored Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.372 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.412 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.3 mp0 -27.61 -51.38 0.07 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.715 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 12.9 m-80 -71.41 49.07 0.15 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -178.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.412 ' H ' ' C ' ' A' ' 84' ' ' GLU . 7.1 p -112.39 115.4 49.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.389 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.62 160.06 28.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.051 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.83 -44.45 61.09 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.708 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.25 -45.29 88.08 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.79 0.328 . . . . 0.0 110.795 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.45 -44.1 79.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.686 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -59.09 -46.22 88.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.637 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.04 88.37 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.937 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.83 -44.09 81.71 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.764 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 98' ' ' LYS . 9.5 m -50.18 -40.05 45.73 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.662 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.83 -46.85 80.16 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.793 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.97 -44.93 79.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.065 0.433 . . . . 0.0 111.114 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -62.33 -36.25 81.59 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.875 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -58.06 -34.48 70.16 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.9 m -71.0 -43.29 68.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.705 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 83.4 mt -59.57 -50.75 72.69 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.128 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 104' ' ' VAL . 22.0 t -66.14 -31.66 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.954 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.9 -32.61 72.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.105 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -48.67 62.97 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 101' ' ' VAL . 6.7 m -71.19 -28.67 33.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 56.1 t -101.22 102.05 12.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -99.48 -32.03 11.33 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.456 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -85.9 86.12 7.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.818 0.342 . . . . 0.0 111.343 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.449 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 p90 -140.25 158.01 44.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.702 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.83 -59.6 1.67 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.492 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 151.57 47.49 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.283 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -139.69 135.83 33.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.998 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -160.14 165.62 31.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.03 0.443 . . . . 0.0 111.271 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 20.2 t -111.24 139.03 37.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.521 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 49.2 mt -124.3 142.41 41.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.324 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.9 p -135.12 26.5 3.54 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.362 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -138.09 138.05 38.34 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.417 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -60.5 -35.15 75.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.684 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.66 -46.9 71.08 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.521 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 1.7 mp0 -69.39 -28.95 66.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.843 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.416 HD13 ' CZ3' ' A' ' 81' ' ' TRP . 0.4 OUTLIER -67.01 -30.61 70.76 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.728 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -52.17 132.12 33.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -52.44 -35.07 51.34 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.991 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -61.67 -38.93 89.59 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.868 0.366 . . . . 0.0 110.607 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.521 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 7.9 t80 -68.82 -51.58 39.22 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 5.1 mt -54.68 -40.67 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.964 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -51.26 -41.9 60.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.006 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.7 t -70.88 -42.52 69.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -56.02 -34.65 66.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.711 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.444 HD22 ' HB2' ' A' ' 64' ' ' PHE . 0.3 OUTLIER -64.99 -50.27 66.99 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.556 0.217 . . . . 0.0 111.408 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 tttm . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.283 -179.751 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.8 0.333 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -106.81 164.74 11.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.156 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.43 ' HB ' HD12 ' A' ' 36' ' ' ILE . 5.2 tt -115.26 130.38 69.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.021 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.62 101.98 8.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.472 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.36 -41.07 92.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.909 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -59.67 -51.63 68.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.948 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.12 -52.83 63.22 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.951 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.46 -39.39 73.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.153 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -44.94 96.32 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.99 67.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.25 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.41 -48.21 73.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.264 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.18 -46.97 79.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.886 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -55.89 -40.84 73.58 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.9 tp -65.46 -44.52 86.92 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.972 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.6 t -65.89 -35.01 74.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.779 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -61.17 -33.54 73.6 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 C--O 1.233 0.217 0 CA-C-O 121.034 0.445 . . . . 0.0 111.054 179.867 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.2 t -144.99 125.37 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-O 120.732 0.301 . . . . 0.0 110.906 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.3 pp -112.46 -28.57 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.749 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -131.24 155.61 46.81 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 34.7 m -140.85 149.51 20.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.005 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.63 175.89 6.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.85 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -151.13 93.59 1.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.404 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -102.87 176.0 5.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -89.67 144.11 26.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.111 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.505 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.5 OUTLIER -122.77 79.09 1.6 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.888 178.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -72.58 2.13 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.468 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.4 m -150.13 31.89 0.68 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.806 0.336 . . . . 0.0 110.766 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.0 p -146.39 176.97 9.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.033 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' A' ' 5' ' ' ILE . 10.9 mt -106.85 131.39 56.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.182 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.505 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 23.2 m -145.73 138.45 13.89 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.926 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.21 168.22 3.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.468 2.112 . . . . 0.0 112.804 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.73 -153.78 7.15 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.993 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.425 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.4 mp0 -35.47 141.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.286 0.634 . . . . 0.0 112.428 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -136.84 98.12 3.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.356 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.42 168.62 25.76 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.839 -0.695 . . . . 0.0 113.209 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -87.88 -19.35 27.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.634 0.254 . . . . 0.0 110.86 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -89.97 111.27 22.29 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.7 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -68.0 -24.53 65.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.603 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.63 -36.09 15.07 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.016 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.25 -35.31 79.92 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.264 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -68.03 -40.6 82.86 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.561 0.22 . . . . 0.0 111.04 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 18.1 mt -64.31 -44.69 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.167 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -64.64 -40.8 96.09 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.768 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.39 -29.2 59.75 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.5 83.94 3.9 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.962 0.41 . . . . 0.0 111.35 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.61 173.59 8.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.577 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.2 2.8 17.03 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.658 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -126.41 77.37 1.69 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.751 0.31 . . . . 0.0 110.586 -179.659 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -170.11 -175.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.372 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.39 74.36 0.09 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.2 pp -129.39 168.12 16.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.338 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -96.38 170.54 9.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.87 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.0 145.21 34.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.972 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.406 ' HB3' ' CG2' ' A' ' 27' ' ' VAL . 1.1 t80 -132.77 128.55 37.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -150.38 134.31 8.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.841 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 ttp-105 -103.91 132.38 50.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -104.3 161.65 13.88 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.919 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.724 179.506 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.627 0.251 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mtmt -137.56 144.31 41.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.435 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.446 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 6.4 m-85 -90.03 153.54 20.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.034 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.31 114.88 9.41 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.243 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.33 93.22 4.86 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.638 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 5.4 mt -96.53 155.61 3.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.1 m -133.72 132.0 40.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.668 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.502 ' CE3' HD23 ' A' ' 120' ' ' LEU . 55.1 t-105 -108.71 129.38 55.36 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.853 0.359 . . . . 0.0 110.97 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.422 HG13 HG21 ' A' ' 86' ' ' VAL . 2.9 tt -125.73 100.87 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.718 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -75.37 113.91 4.1 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.086 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.433 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.6 mm-40 -24.56 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.658 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.3 m-80 -71.26 44.27 0.09 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.105 0.479 . . . . 0.0 111.67 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.433 ' H ' ' C ' ' A' ' 84' ' ' GLU . 9.0 t -77.47 142.58 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.471 179.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 162.05 29.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.029 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.17 -61.92 6.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.975 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -34.55 76.2 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.491 0.186 . . . . 0.0 111.217 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -33.36 68.74 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.29 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -52.91 -38.38 61.73 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.983 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.3 -37.09 23.9 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.101 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -57.59 -43.32 84.55 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.298 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.6 p -59.26 -37.6 78.02 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.267 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.92 -50.43 60.95 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.613 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.9 t -67.64 -31.54 71.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.624 0.249 . . . . 0.0 111.018 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.414 ' HA ' HD11 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.73 -39.17 83.79 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.243 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -57.0 -33.42 67.12 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.786 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.9 m -72.48 -44.33 62.45 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.414 HD11 ' HA ' ' A' ' 97' ' ' ASP . 17.5 mt -59.56 -45.31 92.22 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.991 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 46.1 t -65.78 -40.04 86.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 -36.6 80.68 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -45.76 78.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.739 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 29.6 t -71.87 -45.65 63.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.04 101.57 12.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.869 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -107.57 -32.24 7.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.443 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -81.44 71.82 8.45 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.903 0.382 . . . . 0.0 110.669 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.446 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 19.9 p90 -124.16 162.26 23.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.068 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.29 -46.52 5.78 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.66 132.0 15.58 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.067 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -133.43 127.87 34.3 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -160.35 162.45 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.981 0.42 . . . . 0.0 111.604 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.2 p -109.07 143.02 20.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.534 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.469 HD12 HD13 ' A' ' 120' ' ' LEU . 4.4 mt -128.13 136.99 58.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.9 m -100.96 -31.52 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.063 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -88.6 139.09 30.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.947 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 mmm-85 -70.5 -36.45 73.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.167 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -47.86 77.57 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.674 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -70.07 -23.85 63.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.008 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.502 HD23 ' CE3' ' A' ' 81' ' ' TRP . 6.7 tp -81.61 -21.64 38.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.8 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -47.88 138.78 8.41 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.094 0.473 . . . . 0.0 111.567 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -35.44 21.52 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.049 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -38.84 75.59 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.983 0.42 . . . . 0.0 110.175 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -77.85 -42.04 34.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 49.8 mt -58.75 -50.09 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.029 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -54.8 -39.32 68.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.2 t -72.4 -44.37 62.57 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -58.12 -48.1 81.26 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.976 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.02 -31.5 71.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.101 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.957 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.643 0.259 . . . . 0.0 110.677 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -135.69 -179.9 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.006 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 tt -146.29 133.13 14.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.886 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.489 ' HB3' HG13 ' A' ' 37' ' ' VAL . 6.8 t70 -77.27 112.74 14.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.744 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.44 -45.28 76.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.058 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.81 -50.17 74.84 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.0 -57.0 14.74 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.305 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.2 m -58.49 -46.66 86.24 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.407 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -60.42 -49.66 76.68 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.42 -47.65 69.41 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.903 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.03 72.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.452 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -66.09 -62.1 1.67 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.31 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -64.08 -32.8 74.5 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.919 0.341 . . . . 0.0 111.919 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.5 tt -61.55 -49.66 75.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.749 0.309 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.7 t -75.4 -32.03 24.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -4.35 41.5 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.896 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.234 0.247 0 CA-C-O 120.813 0.34 . . . . 0.0 111.14 -179.797 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 41' ' ' GLN . 49.4 t -152.92 101.77 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.281 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -85.81 -27.35 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.644 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 21.9 p-90 -138.46 153.85 48.84 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.344 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 3.4 t -139.45 152.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.992 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.583 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 1.7 m -92.15 165.85 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.757 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -149.69 99.45 2.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.225 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 153.09 52.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.855 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 36' ' ' ILE . 55.1 p90 -96.07 128.77 43.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.414 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.19 109.02 21.85 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.842 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.62 -50.66 3.87 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.195 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.6 p -171.14 -33.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -83.5 132.62 34.93 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.876 0.37 . . . . 0.0 111.41 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' TYR . 50.7 mt -79.5 136.07 24.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.954 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.489 HG13 ' HB3' ' A' ' 6' ' ' ASP . 15.6 m -151.03 155.94 35.19 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.86 164.72 30.51 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.318 2.012 . . . . 0.0 112.09 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.583 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -134.38 -150.76 6.23 Favored Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.554 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.6 mp0 -31.59 136.13 0.06 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.461 0.705 . . . . 0.0 112.579 -179.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.418 ' HB3' HG13 ' A' ' 24' ' ' VAL . 8.2 mt-30 -130.69 91.37 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.228 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.66 164.18 25.18 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.26 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.446 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -88.35 -23.46 23.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.686 0.279 . . . . 0.0 110.718 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.96 115.51 22.85 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.688 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -67.22 -22.46 65.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.93 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -48.07 -37.2 14.59 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.663 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -38.67 91.87 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.298 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -67.91 -41.73 82.23 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.633 0.254 . . . . 0.0 111.013 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.8 mt -63.51 -42.49 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.64 -40.5 73.05 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.642 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -34.29 68.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.623 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.5 m -76.44 82.98 3.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.961 0.41 . . . . 0.0 111.431 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.49 162.18 24.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -84.83 13.27 6.04 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.638 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -129.2 52.71 1.94 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 110.721 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.422 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 171.69 148.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.847 -179.492 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.3 129.13 56.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.73 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.43 174.47 10.6 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -115.79 167.2 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.264 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.82 154.01 35.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 111.415 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -136.21 110.07 8.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.12 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 t -115.29 122.68 69.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.723 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.41 107.72 18.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.84 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -103.59 159.17 15.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.052 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.8 t . . . . . 0 C--N 1.332 -0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.685 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.84 0.352 . . . . 0.0 111.019 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.6 mttm -130.87 121.99 26.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.961 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -96.08 117.6 31.03 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.426 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.07 138.39 52.91 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.488 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.5 tp -117.7 100.18 7.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.0 mt -85.95 113.66 24.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.077 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.409 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 4.5 m -99.53 108.69 21.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.528 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -98.52 141.12 31.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.885 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.444 HD11 HG23 ' A' ' 82' ' ' ILE . 46.2 mt -139.9 94.1 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.261 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.84 109.77 2.9 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.518 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.459 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.3 mm-40 -33.78 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.638 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.6 m-80 -73.13 41.81 0.11 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.273 0.558 . . . . 0.0 111.575 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.459 ' H ' ' C ' ' A' ' 84' ' ' GLU . 2.5 m -99.26 137.33 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.348 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 m -66.28 165.55 13.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.772 0.32 . . . . 0.0 111.23 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.08 -36.47 67.89 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.98 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.81 -36.12 82.86 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.553 0.216 . . . . 0.0 111.083 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -36.77 84.55 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.042 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.94 -45.27 78.84 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.782 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -35.71 74.19 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.197 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.11 -41.82 68.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.475 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -58.04 -39.26 77.99 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.136 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.23 -49.21 67.64 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.379 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -42.94 88.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.586 0.231 . . . . 0.0 110.964 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.39 -36.11 77.34 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.179 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -34.53 65.75 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.907 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 59.1 m -76.45 -47.79 21.85 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.903 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.87 -47.85 84.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.178 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 45.5 t -64.59 -40.12 87.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.764 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -57.61 -44.96 85.86 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.856 179.376 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -59.7 -41.88 91.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.8 t -72.28 -37.8 59.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.409 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.6 t -125.52 104.15 12.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 120.873 0.368 . . . . 0.0 110.823 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 2.9 mt-30 -109.23 -40.38 4.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.095 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -86.62 85.5 7.3 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.059 0.457 . . . . 0.0 111.109 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -133.61 160.41 37.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.982 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.65 -51.18 29.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.03 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.8 161.7 3.87 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -148.08 150.04 33.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.051 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -157.41 160.79 38.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.152 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.409 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 10.2 p -102.32 142.59 16.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.99 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 3.9 mt -134.68 141.85 42.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.063 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 t -135.15 31.26 3.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.848 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -145.12 136.55 25.18 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.705 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -59.0 -36.56 75.12 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.68 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -69.17 -44.7 71.69 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.556 0.217 . . . . 0.0 110.84 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -73.35 -31.22 63.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.159 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.5 tp -74.0 -28.55 61.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.09 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -45.45 133.18 7.63 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.448 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -51.14 -32.15 22.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.1 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -56.71 -41.38 77.31 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.976 0.417 . . . . 0.0 110.29 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -70.43 -46.01 64.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.903 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 20.1 mm -61.14 -46.12 97.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.228 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -60.53 -37.87 82.58 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.619 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.62 -42.26 74.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.657 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.16 -43.13 99.36 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.093 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -43.4 89.13 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.237 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 40.2 tttt . . . . . 0 CA--C 1.53 0.176 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.16 179.926 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.234 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -134.48 167.37 20.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.025 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -123.29 122.82 66.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.426 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -75.31 107.18 7.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -36.88 74.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.777 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -66.75 -46.64 74.75 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.91 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.77 -51.63 61.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.302 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.2 t -55.48 -44.8 76.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -44.01 87.15 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.77 -49.61 47.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.131 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.56 -36.87 73.88 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.651 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -55.35 -55.1 35.42 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.54 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.434 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 21.6 p30 -75.23 -20.97 58.95 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.3 -44.18 46.94 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.612 0.244 . . . . 0.0 111.318 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.501 HG21 HG13 ' A' ' 27' ' ' VAL . 19.4 t -72.5 -40.16 62.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.513 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -59.16 -25.75 64.17 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.49 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.807 0.337 . . . . 0.0 110.797 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.989 0.423 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.2 t -129.0 108.42 17.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.033 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.424 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.2 pt -106.32 -29.89 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.513 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 31.0 p-90 -135.16 155.99 49.76 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.928 0.394 . . . . 0.0 111.179 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.501 HG13 HG21 ' A' ' 17' ' ' VAL . 16.7 m -141.38 149.05 20.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.225 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.502 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 0.6 OUTLIER -92.68 175.94 6.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.59 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 5.6 m-85 -144.82 104.73 4.04 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.007 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.98 -179.2 4.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.401 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -84.09 163.74 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.52 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.459 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -147.36 84.63 1.57 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.817 179.333 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 75.15 -68.64 2.0 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.303 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -156.68 34.88 0.31 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.8 t -158.39 158.46 34.28 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.414 HG12 ' OD2' ' A' ' 97' ' ' ASP . 3.6 mt -84.93 134.6 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.12 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.459 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 30.7 m -147.54 157.36 44.85 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.009 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.448 ' HD2' ' HB ' ' A' ' 37' ' ' VAL . 37.9 Cg_endo -65.88 171.37 9.99 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.335 2.023 . . . . 0.0 112.146 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.502 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -135.91 -151.91 6.25 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.53 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.513 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.35 140.27 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.418 0.687 . . . . 0.0 112.248 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.412 ' CG ' HG11 ' A' ' 27' ' ' VAL . 10.0 mt-30 -135.33 100.94 4.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.184 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.52 161.5 24.48 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.128 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.56 -26.75 34.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 0.0 110.52 179.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -96.04 122.42 38.85 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.533 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -68.2 -18.09 64.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.905 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -47.58 -40.12 18.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.623 0.249 . . . . 0.0 110.973 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.19 -39.66 91.03 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.226 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -66.43 -47.6 72.67 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.893 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.9 mt -58.18 -38.5 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.714 0.292 . . . . 0.0 110.781 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.41 -36.38 83.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.574 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.06 -23.44 22.55 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -73.46 81.97 1.45 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.212 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.2 p -109.48 146.13 35.09 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.638 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.543 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.7 m-20 -80.07 70.14 6.61 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.01 0.433 . . . . 0.0 111.385 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.694 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.9 t70 -165.5 45.08 0.08 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.204 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' A' ' 57' ' ' ARG . 2.9 p 178.29 -147.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.535 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -163.71 123.41 2.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.392 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.1 pp -158.85 156.8 30.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.878 0.371 . . . . 0.0 111.322 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.533 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 67.3 m-85 -99.69 172.21 7.41 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.554 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.22 156.22 41.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.415 ' CE2' HD13 ' A' ' 78' ' ' LEU . 1.2 t80 -147.24 122.11 9.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.68 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.8 t -130.98 143.05 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-O 120.888 0.375 . . . . 0.0 111.507 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD2' ' CG1' ' A' ' 17' ' ' VAL . 60.7 mtt85 -121.71 112.67 18.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.551 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -95.45 165.52 12.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.269 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.777 179.805 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.839 0.352 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -130.25 162.04 29.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.932 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -130.37 146.92 52.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.617 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -146.76 111.51 5.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.494 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 14.8 tp -103.48 86.74 2.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.895 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 mp -96.26 141.4 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.249 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.7 m -114.35 124.18 51.34 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.431 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.7 t-105 -94.18 133.55 37.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.834 0.349 . . . . 0.0 110.745 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.0 tt -128.33 90.82 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.837 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.543 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.56 111.33 4.06 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.709 -0.757 . . . . 0.0 111.692 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.418 ' C ' ' H ' ' A' ' 86' ' ' VAL . 6.0 mm-40 -37.07 -45.84 0.63 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -178.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.694 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.1 m-80 -73.68 46.54 0.22 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.418 ' H ' ' C ' ' A' ' 84' ' ' GLU . 12.4 p -104.89 134.59 45.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.25 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 p -63.17 153.87 33.02 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.938 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.36 58.58 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 113.2 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -43.25 92.22 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.797 0.299 . . . . 0.0 111.073 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -67.68 -33.78 75.61 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.997 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -34.63 69.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.951 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.56 -33.93 27.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.949 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.5 tptt -56.13 -44.07 78.82 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.477 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.6 t -61.35 -34.16 74.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.727 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.54 -48.88 82.16 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.06 -0.59 . . . . 0.0 112.103 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -38.44 86.35 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.568 0.223 . . . . 0.0 110.718 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.414 ' OD2' HG12 ' A' ' 36' ' ' ILE . 4.5 m-20 -60.98 -44.88 96.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.099 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.4 ttpt -58.79 -29.9 67.18 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.8 m -71.99 -45.37 61.23 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.448 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.2 mt -62.33 -47.65 83.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.098 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.418 ' O ' HG11 ' A' ' 104' ' ' VAL . 12.5 p -66.2 -32.77 59.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -68.46 -38.18 80.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.763 0.316 . . . . 0.0 110.837 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -47.22 68.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.418 HG11 ' O ' ' A' ' 101' ' ' VAL . 14.8 p -71.04 -33.13 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.642 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -109.17 91.87 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.939 0.399 . . . . 0.0 110.714 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -98.83 -35.96 9.95 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.046 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -79.43 79.78 5.86 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 110.829 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -127.84 -179.78 5.13 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -114.11 -50.98 2.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.344 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -145.16 150.96 37.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 7.7 pt-20 -151.99 128.39 10.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 16.4 p90 -159.78 159.43 32.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.341 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.73 146.1 7.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.727 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 58.7 mt -132.85 144.71 35.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.11 31.26 2.43 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.078 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -147.07 140.54 25.54 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.916 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.421 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -60.9 -34.96 75.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.462 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.1 tttm -75.3 -37.85 60.62 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.73 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -67.2 -45.09 77.91 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.825 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.421 ' CD2' ' HA ' ' A' ' 117' ' ' ARG . 4.5 pp -72.02 -22.15 61.45 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.343 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -48.27 133.57 15.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.769 0.319 . . . . 0.0 110.874 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -49.15 -34.09 13.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.058 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -60.09 -46.29 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.894 0.378 . . . . 0.0 110.285 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -68.51 -44.23 75.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.107 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 37.5 mm -59.85 -45.24 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.13 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -57.34 -39.85 76.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.105 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.7 t -71.52 -46.19 60.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.727 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -57.08 -39.84 75.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mp -72.51 -37.75 68.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.522 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 45.5 tptt . . . . . 0 C--O 1.232 0.175 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.5 -179.609 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -104.86 162.28 13.46 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.09 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -118.73 135.45 59.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.07 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.468 ' HB2' HG13 ' A' ' 37' ' ' VAL . 1.4 m-20 -85.32 115.02 22.83 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.4 -41.64 93.44 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.078 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.32 -44.78 78.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.147 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.24 -59.57 5.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.238 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.8 m -55.73 -43.68 76.82 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.384 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -65.02 -41.66 95.08 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.467 ' HA ' ' ND2' ' A' ' 15' ' ' ASN . . . -55.18 -55.53 30.21 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.845 0.355 . . . . 0.0 110.733 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.59 -38.49 81.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.412 ' O ' HG21 ' A' ' 17' ' ' VAL . 1.0 OUTLIER -57.68 -50.53 72.88 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.467 ' ND2' ' HA ' ' A' ' 12' ' ' ALA . 13.0 p30 -62.13 -29.49 70.37 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.84 -45.36 15.65 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.691 0.281 . . . . 0.0 111.34 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.412 HG21 ' O ' ' A' ' 14' ' ' TYR . 27.1 m -64.82 -29.75 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.698 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -56.62 -40.07 74.73 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.177 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.5 t70 . . . . . 0 C--O 1.233 0.185 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.604 179.631 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.3 t -139.13 114.54 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.74 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.44 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.3 pt -110.97 -27.56 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.42 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 40.8 p-90 -128.19 161.82 28.41 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.883 0.373 . . . . 0.0 111.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -144.07 151.87 16.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.521 179.178 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.429 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 64.0 m -93.21 161.08 14.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.692 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -146.12 99.24 3.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.997 0.427 . . . . 0.0 110.274 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.23 -179.57 5.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.703 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.49 ' HB3' HD13 ' A' ' 36' ' ' ILE . 52.2 p90 -131.54 132.94 44.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.204 0.526 . . . . 0.0 111.547 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -104.03 114.0 27.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.238 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.67 -74.35 1.78 Allowed Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.998 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 m -162.09 33.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.542 0.21 . . . . 0.0 111.515 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.4 p -140.7 134.58 30.55 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.851 0.357 . . . . 0.0 111.039 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.49 HD13 ' HB3' ' A' ' 31' ' ' TYR . 39.9 mm -81.69 130.9 35.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.814 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.468 HG13 ' HB2' ' A' ' 6' ' ' ASP . 16.7 m -152.62 142.59 15.01 Favored Pre-proline 0 C--O 1.233 0.212 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.213 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -60.24 165.7 10.4 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.504 2.136 . . . . 0.0 112.276 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -134.95 -149.05 5.8 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.449 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.1 mp0 -34.88 136.48 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.388 0.675 . . . . 0.0 112.514 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -137.32 98.87 3.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.281 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.68 165.85 27.09 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.415 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.44 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.32 -22.04 33.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.679 -0.26 . . . . 0.0 110.79 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -88.45 109.44 20.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.537 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -66.86 -21.12 66.02 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.4 -39.2 21.67 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.767 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.51 -36.97 84.25 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.3 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -70.11 -42.08 73.13 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.903 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 63.3 mt -60.51 -40.41 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.753 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -70.8 -36.15 72.86 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.438 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -34.34 58.59 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.695 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.29 82.96 1.38 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 111.656 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.16 155.9 25.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.77 11.27 6.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.709 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -128.25 53.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.833 0.349 . . . . 0.0 110.912 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.406 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.48 153.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.143 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.454 ' HD2' ' HB ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -111.18 143.1 42.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.738 179.289 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -160.55 177.22 10.74 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.785 0.326 . . . . 0.0 111.591 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -116.49 158.73 23.13 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.937 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.99 164.27 34.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.985 0.421 . . . . 0.0 111.614 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -150.81 121.48 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.242 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 39.7 t -124.96 134.34 67.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.601 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -93.08 113.8 26.15 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.217 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.4 143.22 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.373 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.497 179.843 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.596 0.236 . . . . 0.0 110.677 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -144.79 157.07 44.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.874 0.369 . . . . 0.0 111.366 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -110.78 137.81 47.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.591 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.74 128.54 37.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.27 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tt -89.78 132.19 35.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.443 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 14.8 mt -123.92 125.02 70.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.496 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.9 m -106.54 119.82 40.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.093 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 37.6 t-105 -98.52 137.4 37.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 111.498 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 53.3 mt -137.4 87.27 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.932 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -63.2 106.46 1.33 Allowed Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.785 -0.643 . . . . 0.0 113.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 1.02 -65.22 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.709 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 30.4 m-80 -45.94 -21.66 0.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.408 HG11 ' HB2' ' A' ' 90' ' ' GLN . 53.5 t -54.53 107.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.615 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 m -74.3 173.07 10.73 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.33 -43.15 57.37 Favored Glycine 0 C--N 1.336 0.567 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.061 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.58 -46.99 73.83 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.713 0.292 . . . . 0.0 110.808 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.408 ' HB2' HG11 ' A' ' 86' ' ' VAL . 9.3 mp0 -68.24 -37.67 81.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.358 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -58.03 -35.87 71.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 -38.91 71.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.93 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -59.72 -49.05 79.23 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.164 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.454 ' HB ' ' HD2' ' A' ' 57' ' ' ARG . 9.2 t -61.04 -33.38 73.21 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.23 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.72 93.65 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.963 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.18 -38.72 66.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.56 0.219 . . . . 0.0 110.498 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -58.19 -41.4 83.87 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.344 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -55.79 -33.68 64.6 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.745 0.307 . . . . 0.0 110.648 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.2 m -70.52 -44.43 67.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.426 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 61.9 mt -58.38 -49.35 77.56 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.674 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.1 t -64.98 -38.85 83.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.022 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 ttmt -60.95 -44.34 97.41 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.145 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -58.42 -45.34 88.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.69 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 t -74.89 -41.05 46.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 38.8 t -104.53 74.48 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 121.067 0.461 . . . . 0.0 110.754 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -77.62 -26.37 50.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.418 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.98 83.57 5.86 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.843 0.354 . . . . 0.0 110.73 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -132.42 158.43 42.02 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -110.51 -48.93 3.1 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.341 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.55 116.7 7.88 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.026 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -122.32 131.21 53.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.964 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -158.01 154.95 28.52 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.028 0.442 . . . . 0.0 111.51 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.3 m -89.68 156.28 3.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.357 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 57.8 mt -138.51 140.6 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.955 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -124.25 13.35 8.93 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.78 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -148.44 144.28 27.32 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.942 0.401 . . . . 0.0 110.871 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -60.27 -29.71 68.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.989 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -46.75 88.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.731 0.301 . . . . 0.0 110.855 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.414 ' HG2' ' CZ ' ' A' ' 124' ' ' PHE . 1.0 OUTLIER -74.26 -25.81 59.84 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.621 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.41 -22.77 32.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.675 0.274 . . . . 0.0 111.045 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.434 ' HG2' ' OD1' ' A' ' 123' ' ' ASN . 12.5 tt0 -54.48 133.13 45.81 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.76 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -49.15 -45.08 43.29 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.177 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.434 ' OD1' ' HG2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -58.48 -32.79 69.1 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.25 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.414 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 20.6 t80 -74.81 -51.01 15.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.824 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 21.6 mt -59.0 -48.18 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.071 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -55.0 -38.6 68.06 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.9 t -66.09 -49.11 68.69 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.04 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -60.26 -50.27 74.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.91 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.09 -37.19 84.12 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.4 tttp . . . . . 0 N--CA 1.464 0.229 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.612 -179.576 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.796 0.331 . . . . 0.0 110.743 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -100.25 147.21 26.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.516 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.9 tt -124.68 131.05 73.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -89.08 108.11 19.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.565 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -67.9 -34.05 75.89 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.153 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -54.89 40.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.218 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.97 -46.28 71.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.339 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 m -58.32 -45.09 88.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.302 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -68.77 -45.08 72.31 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.52 -46.66 73.56 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.781 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.07 -47.62 83.84 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -56.2 -43.32 78.37 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.143 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -59.44 -46.17 89.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tt -65.31 -43.75 90.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.826 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.6 t -66.72 -31.18 52.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.729 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -37.71 70.57 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.699 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.234 0.256 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.703 179.539 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.448 HG22 ' HG2' ' A' ' 41' ' ' GLN . 92.5 t -54.77 118.54 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.604 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 43' ' ' ALA . 31.7 pt -113.78 -36.29 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.718 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.483 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.3 p-90 -136.21 157.61 46.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.037 0.446 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.426 HG12 ' HG3' ' A' ' 41' ' ' GLN . 4.6 m -138.64 144.74 29.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.473 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.43 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 97.5 m -84.9 162.53 19.43 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.553 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.502 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 6.9 m-85 -144.75 96.41 2.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.127 0.489 . . . . 0.0 110.21 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -125.86 179.93 4.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.681 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -109.4 125.4 52.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.926 0.393 . . . . 0.0 111.301 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.84 101.04 12.83 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.02 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.12 -68.89 2.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.887 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.7 p -160.17 33.08 0.17 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.633 0.254 . . . . 0.0 111.231 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -149.91 131.06 14.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.6 mm -71.31 129.68 35.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.986 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.0 m -152.22 157.43 33.95 Favored Pre-proline 0 C--O 1.234 0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.111 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -62.46 162.59 23.57 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.653 2.236 . . . . 0.0 112.499 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.43 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -138.22 -146.93 5.11 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.706 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 1.9 mp0 -30.3 133.88 0.06 Allowed 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.499 0.719 . . . . 0.0 112.895 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.448 ' HG2' HG22 ' A' ' 24' ' ' VAL . 6.7 tt0 -131.42 101.14 5.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.001 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.03 165.32 25.16 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.503 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.449 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.37 -12.13 33.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.254 0.222 . . . . 0.0 111.464 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -116.08 134.04 55.37 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.668 0.271 . . . . 0.0 110.542 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -69.96 -19.16 63.37 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.894 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -49.81 -40.12 40.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.651 0.262 . . . . 0.0 110.84 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -36.16 79.22 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.403 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 52' ' ' CYS . 42.2 t80 -64.78 -61.12 2.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 121.289 -0.164 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 40.6 mt -57.59 -30.77 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.159 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -47.0 85.8 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.905 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -99.57 -0.16 41.03 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -88.45 88.83 7.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.036 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.1 156.86 17.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.921 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.1 p-10 -80.48 62.44 4.58 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.512 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.695 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 2.2 t0 -161.62 43.45 0.15 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.314 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.434 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.86 153.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.722 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.7 127.3 52.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.327 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 13.4 mt -142.58 156.38 45.09 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.924 0.392 . . . . 0.0 111.671 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.502 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 78.9 m-85 -104.29 161.22 14.23 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.186 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.405 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -154.15 146.47 23.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.879 0.371 . . . . 0.0 111.505 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -128.56 110.7 12.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.523 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.2 t -125.93 131.13 72.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.889 0.376 . . . . 0.0 111.361 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.9 mtm-85 -88.3 151.48 22.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.692 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -127.83 158.98 36.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.2 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.732 179.716 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.751 0.31 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -143.3 157.0 44.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -107.49 147.74 30.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.71 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -147.7 115.81 6.52 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.445 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.6 tt -94.21 106.48 18.45 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.179 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.0 mm -94.67 120.95 44.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.285 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.95 123.81 48.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.252 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -105.85 136.01 46.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.462 ' CG2' HG21 ' A' ' 86' ' ' VAL . 36.7 mt -137.6 93.36 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.468 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -64.38 112.28 4.86 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.573 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.447 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.6 mt-10 -24.72 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.695 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.3 m-80 -72.16 43.23 0.1 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.462 HG21 ' CG2' ' A' ' 82' ' ' ILE . 11.6 t -75.77 126.87 36.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.596 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.5 p -73.11 163.74 27.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.991 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.08 -38.77 39.96 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 121.215 -0.517 . . . . 0.0 113.084 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.6 mp -81.6 -40.52 22.88 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -37.32 74.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.458 -179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -41.39 89.11 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.628 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.27 -38.54 78.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.753 179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -52.87 -41.45 64.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.21 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 m -52.51 -46.78 66.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.376 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.7 -47.71 74.02 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.917 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -45.51 90.61 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.989 0.395 . . . . 0.0 111.008 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.425 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 78.6 m-20 -64.69 -39.21 93.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.318 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -57.27 -33.6 67.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.767 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.1 m -71.33 -48.7 48.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.557 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 52.6 mt -56.04 -51.69 66.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 44.1 t -60.81 -39.55 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.143 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -55.0 -41.92 71.86 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.999 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.84 -34.08 66.56 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.228 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.64 -47.08 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.531 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 26.4 t -106.89 114.98 47.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -107.24 -29.08 9.53 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.283 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -93.83 88.0 5.61 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.737 0.303 . . . . 0.0 111.03 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -141.61 168.75 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.38 -53.87 2.9 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.456 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -150.34 147.44 27.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.605 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -142.88 120.12 11.52 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.61 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -145.84 148.47 32.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.874 0.368 . . . . 0.0 111.262 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 6.1 m -81.31 160.59 3.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.474 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.533 HG23 ' N ' ' A' ' 120' ' ' LEU . 77.3 mt -141.09 132.86 28.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.103 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 m -116.61 -17.65 10.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.846 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.47 151.99 32.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.891 0.377 . . . . 0.0 111.176 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.479 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 32.1 ttp180 -64.2 -26.41 68.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.615 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 6.9 tptp -68.31 -38.06 81.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.993 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.453 ' HG2' ' CZ ' ' A' ' 124' ' ' PHE . 1.2 mt-10 -73.4 -39.31 65.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.646 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.533 ' N ' HG23 ' A' ' 114' ' ' ILE . 4.2 pp -74.77 -15.97 60.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.251 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -51.46 130.15 26.87 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.986 0.422 . . . . 0.0 110.697 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -48.05 -44.74 31.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.714 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -62.8 -41.31 99.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.939 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.453 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 32.9 t80 -59.47 -52.24 66.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.22 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 11.5 mt -55.21 -42.9 68.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.914 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -57.29 -40.99 78.92 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 32.6 t -69.27 -41.96 76.17 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.71 88.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.253 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mp -71.05 -33.03 69.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.53 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 37.4 tttt . . . . . 0 C--O 1.233 0.197 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.326 -179.632 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.831 0.348 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -136.52 145.04 44.62 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.531 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 13.9 tt -112.72 128.67 69.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -75.69 102.49 5.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.556 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -34.59 74.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.009 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -69.6 -50.12 47.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.898 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.442 ' CB ' HG13 ' A' ' 37' ' ' VAL . . . -62.46 -54.26 42.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.3 t -56.02 -37.09 68.71 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.813 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -60.04 -52.61 64.62 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.59 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.85 -48.77 66.82 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.126 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.27 -36.42 73.23 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.59 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.86 -62.08 2.12 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.267 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -62.55 -33.44 74.94 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -48.39 82.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.675 0.274 . . . . 0.0 110.819 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.0 t -72.58 -30.66 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.46 -36.71 64.4 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.987 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 t70 . . . . . 0 C--O 1.232 0.174 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.58 179.6 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.272 0 CA-C-O 121.054 0.454 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.3 t -141.48 104.46 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.0 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.1 pp -108.62 -26.37 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.563 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 26.8 p-90 -135.65 157.9 45.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.859 0.361 . . . . 0.0 111.333 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.487 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 27.0 m -140.99 150.06 20.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.268 179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.47 174.71 6.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.967 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -149.39 96.02 2.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.187 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.06 175.23 5.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.419 -179.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.433 ' CE2' ' HD3' ' A' ' 93' ' ' LYS . 0.8 OUTLIER -104.18 120.7 41.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.912 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -102.54 89.82 3.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.201 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.63 -79.62 1.38 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.146 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.25 32.06 1.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.786 0.327 . . . . 0.0 111.21 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.6 t -154.36 148.87 26.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.663 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.7 pt -90.04 135.36 26.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.952 0.406 . . . . 0.0 111.232 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.442 HG13 ' CB ' ' A' ' 9' ' ' ALA . 44.6 t -141.98 139.35 18.01 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.602 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.07 153.16 9.48 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.61 2.207 . . . . 0.0 112.248 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -126.17 -152.96 8.25 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.653 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.0 mp0 -34.05 139.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.562 0.745 . . . . 0.0 112.682 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -134.42 94.64 3.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.217 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.08 165.58 21.79 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.782 -0.723 . . . . 0.0 113.301 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -90.59 -19.94 23.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.587 0.232 . . . . 0.0 110.962 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.72 126.24 38.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.766 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -74.03 -16.64 61.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.889 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -51.33 -41.01 60.27 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.657 0.265 . . . . 0.0 111.043 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.01 -29.48 67.66 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.239 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -63.37 -45.36 91.53 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.716 0.293 . . . . 0.0 110.825 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mt -69.13 -42.96 81.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.093 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -55.39 -47.08 76.4 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.483 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -75.94 -33.77 59.84 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.479 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -72.83 81.05 1.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.849 0.357 . . . . 0.0 111.332 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.3 p -107.45 144.92 33.7 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.565 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.05 65.85 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.347 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.732 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.7 OUTLIER -157.83 38.86 0.27 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.417 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.469 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 161.95 163.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.252 0.621 . . . . 0.0 110.365 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.98 124.65 50.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.47 179.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 pp -147.94 145.28 28.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.089 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 97' ' ' ASP . 3.4 m-85 -90.59 166.59 13.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -153.78 172.33 17.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.134 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -152.31 138.47 18.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.2 t -143.52 137.65 25.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.003 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -102.86 127.64 49.97 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.662 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -117.04 159.19 22.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.902 0.382 . . . . 0.0 111.332 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.711 179.526 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.644 0.259 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -141.19 129.14 21.88 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -85.3 141.1 30.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.66 114.13 17.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.509 ' HB3' ' CB ' ' A' ' 111' ' ' GLU . 0.5 OUTLIER -94.96 106.46 18.45 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.542 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 25.6 mm -103.15 115.22 44.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.438 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.414 HG23 ' HA ' ' A' ' 113' ' ' VAL . 5.2 t -109.16 110.66 21.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.324 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -86.5 140.08 30.27 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.7 tt -128.16 84.57 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.352 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.429 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -67.62 116.95 8.3 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.889 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.479 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.0 mm-40 -33.54 -31.68 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.732 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.5 m-80 -73.58 36.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.454 0.57 . . . . 0.0 111.727 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.479 ' H ' ' C ' ' A' ' 84' ' ' GLU . 3.7 m -102.04 113.32 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 70.9 m -65.52 174.28 2.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.952 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -49.18 -45.99 34.37 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.933 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -47.81 80.58 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.674 0.273 . . . . 0.0 110.982 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -63.2 -37.72 88.33 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.106 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -50.66 71.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.775 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.96 72.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.542 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.433 ' HD3' ' CE2' ' A' ' 31' ' ' TYR . 0.3 OUTLIER -56.57 -36.87 69.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.248 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.3 -47.5 85.17 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.832 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.85 -46.55 93.89 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.016 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.0 m -63.81 -33.12 74.96 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.784 0.326 . . . . 0.0 110.722 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 59' ' ' PHE . 0.4 OUTLIER -69.78 -31.18 68.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -34.29 74.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.678 0.275 . . . . 0.0 110.897 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.428 HG21 ' N ' ' A' ' 100' ' ' LEU . 7.4 t -83.68 -33.24 25.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.276 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.428 ' N ' HG21 ' A' ' 99' ' ' THR . 21.1 mt -68.08 -47.76 67.38 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.809 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 37.9 t -68.74 -38.02 78.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.366 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -63.23 -39.46 94.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.704 0.287 . . . . 0.0 110.656 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -65.35 -50.61 64.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.971 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.412 HG11 HG21 ' A' ' 105' ' ' VAL . 14.9 p -71.22 -36.26 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.337 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.412 HG21 HG11 ' A' ' 104' ' ' VAL . 26.1 t -118.15 98.94 7.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.937 0.399 . . . . 0.0 110.837 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -100.95 -36.84 8.89 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.008 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -78.15 81.22 4.54 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 110.74 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -130.18 177.07 7.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.698 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -110.07 -52.58 2.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.112 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -154.95 143.77 20.78 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.894 0.378 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.509 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 13.4 pt-20 -148.06 126.53 12.39 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.529 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -143.79 168.01 20.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.39 . . . . 0.0 111.434 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.414 ' HA ' HG23 ' A' ' 80' ' ' THR . 4.7 t -107.09 130.08 59.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.466 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 41.4 mm -127.51 148.27 32.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.132 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.7 p -138.14 30.94 2.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.992 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -136.29 135.01 38.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.682 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.11 85.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.373 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -63.04 -47.68 81.99 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.479 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -69.71 -30.14 67.71 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.853 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -33.12 74.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.765 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -47.46 131.76 13.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.206 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -51.73 -32.63 31.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.884 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -58.19 -45.18 88.01 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.374 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -67.28 -47.34 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.012 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.87 -47.95 89.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -62.18 -41.76 98.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -45.44 93.26 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.727 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.45 -49.78 72.32 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -37.1 82.5 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.099 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 tttm . . . . . 0 C--O 1.232 0.179 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.948 179.632 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.834 0.35 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -104.08 176.79 5.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.448 ' HB ' HD12 ' A' ' 36' ' ' ILE . 10.0 tt -118.16 123.84 72.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.7 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.4 ' HB3' HG11 ' A' ' 37' ' ' VAL . 7.3 t70 -67.4 111.01 3.82 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.424 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -45.36 88.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.33 -44.48 75.9 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.062 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.49 -54.9 29.03 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -58.19 -47.78 82.38 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.092 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -42.02 99.14 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.895 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.41 -49.42 74.56 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.837 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.79 -32.9 74.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.175 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -57.64 10.41 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.146 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -68.5 -31.32 70.49 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.572 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.5 -49.11 64.96 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.141 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.2 t -71.0 -33.82 53.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.833 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -53.88 -35.58 61.73 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.988 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 . . . . . 0 C--O 1.232 0.154 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.259 179.402 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.297 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.4 ' CG2' ' HB2' ' A' ' 41' ' ' GLN . 12.5 p -111.45 131.69 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.777 0.322 . . . . 0.0 111.634 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 43' ' ' ALA . 18.0 pt -129.48 -41.55 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.484 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 27.9 p-90 -121.69 159.84 25.72 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.965 0.412 . . . . 0.0 111.802 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 12.4 m -142.84 148.08 20.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.588 178.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.514 ' CG2' ' HB2' ' A' ' 40' ' ' GLU . 1.5 t -120.05 115.46 23.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.477 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.449 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 9.3 m-85 -79.64 121.1 24.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.607 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.71 164.75 17.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.87 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -78.66 113.26 16.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.899 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -132.42 108.93 9.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.664 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.54 37.63 58.11 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.521 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 m 64.38 26.85 13.62 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.706 0.288 . . . . 0.0 111.198 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -146.47 153.32 40.3 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.939 0.399 . . . . 0.0 110.735 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.448 HD12 ' HB ' ' A' ' 5' ' ' ILE . 3.0 mp -84.08 128.88 38.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.4 HG11 ' HB3' ' A' ' 6' ' ' ASP . 19.6 m -145.11 144.92 25.16 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.884 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.416 ' HG3' ' CZ ' ' A' ' 29' ' ' PHE . 36.5 Cg_exo -57.26 149.46 64.2 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -130.35 -153.47 7.73 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 121.21 -0.519 . . . . 0.0 112.467 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.577 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.9 mp0 -23.96 132.64 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.791 0.836 . . . . 0.0 112.74 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.422 ' HB3' HG13 ' A' ' 27' ' ' VAL . 1.7 pt20 -134.13 98.86 4.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.158 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.77 164.69 25.18 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.467 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -88.34 -21.12 24.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.609 0.242 . . . . 0.0 110.805 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.12 115.36 28.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.729 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -68.35 -17.69 64.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.407 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.47 -40.84 27.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.664 0.269 . . . . 0.0 110.695 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -37.48 87.56 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.999 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -67.84 -39.57 83.82 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.06 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 53.7 mt -68.46 -48.09 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.992 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.97 -36.19 76.6 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.685 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -24.61 27.49 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.66 82.39 2.05 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.829 0.347 . . . . 0.0 111.456 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.2 p -92.19 171.64 8.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.259 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.442 ' HB3' ' HG3' ' A' ' 84' ' ' GLU . 7.6 m-20 -86.27 19.06 2.85 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.563 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.636 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -134.79 71.95 1.45 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.674 0.273 . . . . 0.0 110.564 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -174.66 -172.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 120.939 0.399 . . . . 0.0 111.533 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.79 102.67 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.18 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -149.53 177.64 9.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -110.36 171.79 7.25 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.1 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.26 164.17 37.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.394 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -153.82 108.89 3.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.828 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.0 t -119.38 139.28 47.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -93.47 105.12 17.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.454 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -84.69 141.84 30.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 -179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.756 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.851 0.358 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -138.88 139.54 38.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.753 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -104.77 123.57 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.878 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -136.64 136.01 38.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.15 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.33 106.59 17.1 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.379 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.0 mt -90.58 121.87 41.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.16 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.434 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 1.7 m -96.29 123.47 39.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.36 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -111.13 134.38 52.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.891 0.377 . . . . 0.0 111.022 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.441 HG21 HD12 ' A' ' 82' ' ' ILE . 39.9 mt -137.75 105.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.031 179.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -68.84 116.57 7.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.624 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.488 ' C ' ' H ' ' A' ' 86' ' ' VAL . 0.1 OUTLIER -38.12 -30.34 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.636 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -72.94 36.24 0.08 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.031 0.444 . . . . 0.0 111.966 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.488 ' H ' ' C ' ' A' ' 84' ' ' GLU . 5.0 m -109.35 127.73 65.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.546 178.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.99 170.45 11.27 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.85 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.03 -42.17 47.38 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.672 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.4 -44.99 93.06 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.854 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -61.69 -41.73 97.97 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.878 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -61.23 -46.06 91.96 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.649 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.24 78.06 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.255 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -55.62 -55.05 36.56 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.856 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -38.55 71.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.58 -45.74 94.2 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.823 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.8 -45.37 36.43 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.668 0.234 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.421 ' HA ' HD11 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -59.76 -38.34 81.54 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.297 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -32.73 69.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.871 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.1 m -70.53 -42.73 70.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.441 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 97' ' ' ASP . 6.4 mt -61.8 -50.07 73.81 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.084 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 13.0 p -62.65 -35.39 70.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.274 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -62.79 -41.79 99.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.714 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -62.83 -37.73 87.94 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.845 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 39.7 t -63.79 -44.89 98.37 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.924 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -121.38 98.55 6.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -95.0 -24.85 16.74 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.555 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -80.16 83.65 5.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.787 0.327 . . . . 0.0 110.89 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -136.23 166.96 22.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.61 -55.35 2.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.318 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -132.74 147.65 52.32 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.288 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -152.0 124.58 8.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.992 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -158.55 161.1 37.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.382 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.434 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 8.7 p -109.31 140.39 28.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.781 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.493 HD13 ' HA ' ' A' ' 120' ' ' LEU . 8.5 mt -131.87 139.37 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 111.337 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.68 -26.24 10.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.947 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -83.9 138.67 33.05 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -35.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.525 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -68.19 -47.45 67.88 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.34 -27.9 68.25 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.204 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 114' ' ' ILE . 1.3 tp -76.37 -28.48 56.79 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.6 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -50.59 135.17 23.39 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.102 0.477 . . . . 0.0 111.164 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.45 -31.65 46.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.121 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.38 -43.79 92.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.802 0.334 . . . . 0.0 110.599 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.38 -48.91 68.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.905 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 15.8 mt -61.96 -37.4 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.25 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.78 -40.49 63.24 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -73.08 -43.02 62.39 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.31 -49.41 74.1 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.185 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.51 -45.47 92.85 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.271 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 43.2 tttt . . . . . 0 C--O 1.232 0.165 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.889 179.684 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.654 0.264 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -103.78 157.61 16.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.487 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.1 tt -128.73 118.83 48.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.471 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HB3' HG12 ' A' ' 37' ' ' VAL . 29.3 t0 -79.97 112.01 16.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.918 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -37.41 58.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -55.37 35.56 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.099 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.469 ' HB2' ' HD2' ' A' ' 38' ' ' PRO . . . -59.53 -49.61 77.11 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.141 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.81 -46.88 84.05 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.899 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtt-85 -62.35 -46.31 89.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.926 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.16 -45.25 79.74 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.796 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.07 -46.52 87.06 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -56.3 -42.24 77.24 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.908 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -43.35 92.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.077 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.3 t -71.38 -31.05 42.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.259 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -39.38 58.91 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.929 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 C--O 1.233 0.22 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.608 179.456 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.6 t -114.46 132.16 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.746 0.308 . . . . 0.0 111.391 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.589 HG12 ' HA ' ' A' ' 43' ' ' ALA . 22.8 pt -129.67 -40.68 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.609 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 24.6 p-90 -123.74 154.24 39.76 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.879 0.371 . . . . 0.0 111.294 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.446 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 6.8 t -138.57 155.05 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.198 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.416 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 0.3 OUTLIER -98.63 169.91 9.17 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.545 179.246 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -150.91 95.87 2.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.995 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -122.01 170.03 10.24 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.969 0.414 . . . . 0.0 111.61 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -80.21 135.87 36.36 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.759 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.513 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.0 m-20 -153.7 116.52 4.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.09 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.83 40.29 75.22 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.928 -0.654 . . . . 0.0 113.014 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m 62.78 28.42 16.47 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.626 0.251 . . . . 0.0 111.494 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.5 t -156.0 149.1 24.39 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.6 mt -78.39 132.24 32.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.171 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.513 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 30.9 m -144.47 154.09 56.18 Favored Pre-proline 0 CA--C 1.531 0.217 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.469 ' HD2' ' HB2' ' A' ' 9' ' ' ALA . 36.5 Cg_endo -64.85 163.45 28.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.429 2.086 . . . . 0.0 112.306 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.416 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -131.18 -153.84 7.69 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.253 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.6 mp0 -36.13 141.74 0.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.445 ' HG3' HG12 ' A' ' 27' ' ' VAL . 8.1 mt-30 -135.71 111.71 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.85 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.75 168.11 34.85 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.543 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.589 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.08 -18.73 29.83 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.723 -0.239 . . . . 0.0 110.956 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.71 119.94 31.35 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.752 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -72.94 -23.11 60.64 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 15.8 tp60 -48.76 -37.33 18.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.637 0.256 . . . . 0.0 110.715 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -33.65 76.51 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.337 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.87 -42.54 63.57 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.687 0.28 . . . . 0.0 111.057 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.6 mt -62.31 -40.55 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.137 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -69.2 -38.35 78.57 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.552 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.97 -42.73 60.04 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.44 -179.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 6.1 m -80.45 84.22 6.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.979 0.419 . . . . 0.0 111.803 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 p -96.89 161.8 13.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.551 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.456 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.5 m-20 -81.89 63.39 6.11 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.123 0.487 . . . . 0.0 111.299 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.708 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.8 t70 -170.08 43.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.741 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 174.1 150.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.525 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.472 ' HB2' ' CG2' ' A' ' 94' ' ' THR . 0.0 OUTLIER -109.9 121.82 46.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.731 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.6 173.38 11.87 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -117.85 172.3 7.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.256 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.37 166.08 31.89 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.47 . . . . 0.0 111.667 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -144.77 112.21 6.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.824 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.5 t -126.14 137.14 58.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.932 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -119.45 124.95 47.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.59 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -111.99 161.8 16.05 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.266 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.233 0.231 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.375 179.289 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -148.16 138.42 22.72 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.947 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -94.07 147.08 23.48 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.552 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.53 142.04 30.97 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.596 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.93 105.15 16.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.389 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 25.4 mm -93.16 113.05 27.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.199 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.3 m -98.77 114.15 26.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.608 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -100.35 137.73 38.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.857 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.528 ' CG2' HG23 ' A' ' 86' ' ' VAL . 40.0 mt -138.57 97.37 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.95 109.7 3.06 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.382 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.46 ' C ' ' H ' ' A' ' 86' ' ' VAL . 36.9 mt-10 -22.23 -46.34 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -179.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.708 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.2 m-80 -70.72 43.68 0.07 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.14 0.495 . . . . 0.0 111.935 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.528 HG23 ' CG2' ' A' ' 82' ' ' ILE . 4.1 t -78.61 145.51 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.277 178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.0 m -83.71 171.28 13.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.02 7.08 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.409 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mp -58.97 -37.3 76.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.72 0.295 . . . . 0.0 110.964 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.69 -34.88 77.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -30.42 71.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.538 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -85.07 -39.0 18.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.975 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.469 ' O ' HG23 ' A' ' 96' ' ' THR . 0.6 OUTLIER -57.0 -33.82 67.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.302 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.472 ' CG2' ' HB2' ' A' ' 57' ' ' ARG . 3.0 p -64.62 -42.09 95.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.543 0.211 . . . . 0.0 110.736 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.48 -49.44 76.65 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.12 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.469 HG23 ' O ' ' A' ' 93' ' ' LYS . 9.9 t -73.64 -30.2 62.8 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 111.505 0.187 . . . . 0.0 111.505 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -58.69 -42.73 89.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.7 0.286 . . . . 0.0 111.039 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -53.77 -32.73 53.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.128 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.9 m -74.98 -41.5 59.41 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.006 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.8 mt -61.66 -49.23 77.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.364 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.65 -37.65 80.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.911 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -61.85 -34.96 76.92 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.042 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -75.18 -47.5 28.03 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.442 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.7 p -66.54 -38.32 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.499 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 43.7 t -127.8 121.5 56.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 120.772 0.32 . . . . 0.0 110.967 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -120.17 3.29 10.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.961 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -89.43 74.55 7.75 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.913 0.387 . . . . 0.0 111.073 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -145.8 147.69 32.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.148 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.82 -41.85 15.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.372 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.28 160.47 43.34 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.813 0.339 . . . . 0.0 111.181 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -150.6 122.64 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.892 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -137.47 166.22 24.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 111.123 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 25.5 t -110.37 139.57 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.631 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 32.7 mm -131.53 151.1 34.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.105 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.1 t -147.1 29.8 0.97 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.017 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -137.52 136.08 37.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.58 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.89 -35.91 82.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.289 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.8 tttm -65.9 -41.87 90.96 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.46 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -73.49 -33.11 64.66 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.59 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.0 mt -61.02 -34.15 74.39 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.432 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -43.43 130.31 5.03 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.333 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -49.69 -36.87 26.64 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.922 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -60.58 -42.6 97.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.893 0.378 . . . . 0.0 110.22 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -69.77 -49.71 50.37 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.952 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.4 mm -55.98 -46.51 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -66.81 -34.7 78.38 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.172 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.3 t -61.97 -48.81 78.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.828 0.347 . . . . 0.0 110.255 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.35 -32.21 71.15 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.712 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.44 -47.47 69.64 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.644 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.591 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -107.98 103.22 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -80.01 113.37 19.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.556 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.446 ' HB3' HG12 ' A' ' 37' ' ' VAL . 16.7 t0 -72.02 106.79 4.42 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -68.26 -40.3 81.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.676 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -60.98 -45.95 92.73 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.65 -57.05 14.61 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.633 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 46.3 t -57.17 -42.83 81.84 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -41.99 96.27 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.906 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.76 -52.85 58.89 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.926 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.43 -33.46 76.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.158 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.96 -57.13 13.4 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.334 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -69.9 -29.81 67.09 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.618 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.46 -48.51 79.3 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.645 0.26 . . . . 0.0 111.128 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.4 -33.74 58.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.45 -18.3 60.66 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.823 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 111.249 -179.877 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.427 ' CG1' ' HB3' ' A' ' 41' ' ' GLN . 48.2 t -141.33 109.42 2.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.746 0.308 . . . . 0.0 110.849 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.2 pt -108.18 -28.84 2.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.542 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.554 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 43.9 p-90 -128.71 158.15 39.38 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.891 0.377 . . . . 0.0 111.312 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 29.2 m -142.34 143.99 25.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.154 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.562 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 3.6 m -82.38 168.09 17.86 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.472 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.425 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 7.7 m-85 -147.46 108.9 4.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 110.496 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -143.88 148.87 36.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.429 ' HA ' ' O ' ' A' ' 35' ' ' THR . 43.7 p90 -98.18 133.69 42.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.569 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.35 108.44 19.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.211 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.0 -71.37 2.21 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.123 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 p -159.8 33.71 0.18 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.205 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.429 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 3.3 t -145.47 126.39 14.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 33.3 mt -83.94 133.28 29.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.446 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.3 m -152.98 156.28 32.64 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.86 160.05 45.88 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.6 2.2 . . . . 0.0 112.242 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.562 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.69 -146.67 6.09 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.494 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.554 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.29 137.32 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.083 0.553 . . . . 0.0 112.412 -179.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.427 ' HB3' ' CG1' ' A' ' 24' ' ' VAL . 14.3 mt-30 -135.22 114.44 12.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.329 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -149.99 160.94 28.72 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.757 -0.735 . . . . 0.0 113.338 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.12 -25.92 36.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.571 0.224 . . . . 0.0 110.815 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.42 121.37 38.15 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.511 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.92 -20.4 64.23 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -37.15 9.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.748 0.309 . . . . 0.0 111.042 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -42.96 99.48 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.402 ' CE2' ' SG ' ' A' ' 52' ' ' CYS . 56.4 t80 -66.88 -45.28 78.54 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.719 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.415 HD13 HG21 ' A' ' 49' ' ' ILE . 55.0 mt -61.42 -36.14 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.959 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -59.5 -47.06 86.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.016 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.88 -17.33 47.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.853 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.402 ' SG ' ' CE2' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -70.86 83.51 0.65 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.115 0.483 . . . . 0.0 111.592 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.2 p -111.09 146.21 37.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.458 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.488 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 2.3 m-20 -78.96 59.94 2.77 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.84 0.352 . . . . 0.0 111.699 -179.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.6 t70 -157.85 36.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.989 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -179.36 174.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.022 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.555 ' HG2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -124.77 133.76 53.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.928 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.39 164.03 32.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.988 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 18.9 m-85 -105.87 166.19 10.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.925 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -143.87 155.52 44.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.578 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.444 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 1.2 t80 -152.07 135.53 16.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.503 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.21 141.93 12.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.855 0.36 . . . . 0.0 111.308 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.469 ' HD2' ' CE2' ' A' ' 76' ' ' PHE . 11.0 ttp180 -108.9 154.44 22.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.439 ' CD1' HD21 ' A' ' 129' ' ' LEU . 71.9 m-85 -125.47 150.47 47.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.656 179.859 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.702 0.286 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -139.83 143.63 36.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.156 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.469 ' CE2' ' HD2' ' A' ' 63' ' ' ARG . 5.5 m-85 -119.18 136.14 54.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 110' ' ' LYS . . . -142.55 140.76 31.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.962 0.411 . . . . 0.0 111.718 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.444 ' HG ' ' CD2' ' A' ' 61' ' ' PHE . 1.2 tt -109.15 119.66 40.2 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.241 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 mp -113.33 127.88 70.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 0.0 111.363 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -102.82 132.68 48.83 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.236 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -109.36 123.96 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.902 0.382 . . . . 0.0 111.421 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.9 tt -114.91 100.32 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.861 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -71.35 73.2 0.75 Allowed Glycine 0 C--N 1.333 0.368 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.932 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 24.11 -75.22 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' A' ' 83' ' ' GLY . 49.5 m-80 -49.0 -18.06 0.26 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 t -36.75 109.24 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 O-C-N 123.229 0.33 . . . . 0.0 111.608 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.8 m -61.3 168.81 2.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.676 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.07 -48.25 86.83 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.467 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.3 tp -57.34 -38.9 74.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.695 0.283 . . . . 0.0 110.533 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.555 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 24.5 mm-40 -68.73 -37.83 79.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.399 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -59.47 -51.45 69.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.431 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.53 87.71 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.94 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.98 -46.0 82.51 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.461 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 63.2 m -60.99 -44.46 97.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.72 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.22 -52.39 49.8 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.703 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.38 -37.43 85.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.59 0.233 . . . . 0.0 110.938 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.406 ' HA ' HD11 ' A' ' 100' ' ' LEU . 1.1 m-20 -57.91 -40.86 81.4 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.945 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -62.46 -29.75 70.75 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.015 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.6 m -67.79 -47.24 69.66 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.722 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.406 HD11 ' HA ' ' A' ' 97' ' ' ASP . 1.4 mt -61.98 -42.54 99.25 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.965 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.96 -31.68 53.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.78 -41.12 96.09 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.932 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.45 -52.68 43.78 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.13 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.29 -34.27 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.3 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 41.1 t -119.29 89.92 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 120.912 0.387 . . . . 0.0 110.713 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -101.52 -24.37 14.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -77.63 84.17 4.0 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.923 0.392 . . . . 0.0 110.841 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.404 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.6 p90 -146.04 164.17 32.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.872 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.52 -47.7 8.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.169 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -165.18 161.86 19.67 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.135 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -150.6 138.89 20.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.789 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -147.0 168.52 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.978 0.418 . . . . 0.0 111.288 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 8.8 p -119.15 139.33 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 38.9 mm -129.69 151.96 36.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.987 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 14.9 m -109.94 -29.28 8.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.244 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -101.42 149.64 23.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.812 0.339 . . . . 0.0 110.872 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -69.44 -21.28 63.74 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.884 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -61.79 -57.74 10.68 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.114 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -75.19 -22.34 58.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.582 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.6 tp -80.23 -25.7 39.46 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.737 -0.21 . . . . 0.0 111.066 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -52.77 144.75 13.62 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.288 0.566 . . . . 0.0 111.667 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -53.38 -33.36 53.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.603 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -41.0 85.4 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.91 0.386 . . . . 0.0 110.446 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -71.34 -45.23 63.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.88 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.7 mt -61.32 -49.09 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.954 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -33.52 70.72 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.284 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.6 t -79.23 -43.95 22.78 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -63.07 -45.67 91.06 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.169 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.439 HD21 ' CD1' ' A' ' 64' ' ' PHE . 0.3 OUTLIER -68.28 -23.81 64.8 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.665 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 20.4 tttm . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.613 0.244 . . . . 0.0 111.11 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.767 0.318 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 35' ' ' THR . 9.2 mttp -95.13 169.79 9.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.4 tt -129.33 124.87 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.576 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.33 106.11 5.81 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.645 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -39.05 84.65 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.754 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -52.52 64.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.957 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.469 ' CB ' HG21 ' A' ' 37' ' ' VAL . . . -66.8 -52.96 37.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.293 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.2 m -53.11 -46.96 68.94 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.27 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -65.14 -41.67 94.55 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.716 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.52 75.01 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.665 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.88 99.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.77 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -59.25 -42.11 90.35 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.979 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -66.52 -41.46 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.065 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 tp -71.28 -48.27 51.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.639 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.08 -29.51 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.336 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -61.19 -34.15 74.61 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.624 0.249 . . . . 0.0 110.703 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 . . . . . 0 C--O 1.235 0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.381 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.432 HG13 ' HB3' ' A' ' 41' ' ' GLN . 26.5 t -132.17 98.53 3.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.703 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -104.61 -30.93 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.536 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 30.4 p-90 -132.28 157.97 43.02 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.881 0.372 . . . . 0.0 111.582 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.44 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -141.63 149.27 20.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.466 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.514 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 90.3 m -88.93 162.47 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.893 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -148.23 96.41 2.62 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.811 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -123.67 152.56 41.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.452 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -105.56 118.07 35.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.95 0.405 . . . . 0.0 111.054 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.11 90.55 0.87 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.43 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.45 -57.52 4.12 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 t -149.66 -35.62 0.17 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.414 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 11.3 t -80.28 130.32 35.12 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.924 0.393 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 33.0 mt -79.29 141.01 15.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.08 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.469 HG21 ' CB ' ' A' ' 9' ' ' ALA . 7.5 p -158.59 138.31 8.59 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.049 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.402 ' HD2' ' CG2' ' A' ' 37' ' ' VAL . 19.4 Cg_endo -59.6 162.61 14.81 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.68 2.253 . . . . 0.0 112.378 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.514 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -131.54 -150.83 6.76 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 121.25 -0.5 . . . . 0.0 112.712 -179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.536 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -38.72 141.44 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.242 0.617 . . . . 0.0 112.47 -179.037 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.432 ' HB3' HG13 ' A' ' 24' ' ' VAL . 19.2 mt-30 -139.32 98.83 3.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.142 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.83 165.86 23.76 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.332 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.445 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.1 -21.92 25.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.627 0.251 . . . . 0.0 110.865 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -97.28 128.06 43.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.536 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -73.95 -20.13 60.46 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.652 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -48.21 -40.74 25.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.828 0.347 . . . . 0.0 110.36 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -39.38 88.23 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.263 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -69.03 -45.22 71.02 Favored 'General case' 0 C--N 1.338 0.066 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.736 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 26.7 mt -57.4 -40.54 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.324 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -68.04 -39.53 83.03 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.03 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -89.98 0.03 57.32 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.5 t -110.03 87.4 2.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.88 0.372 . . . . 0.0 111.425 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.33 176.77 5.59 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.448 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.84 19.58 1.68 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.692 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -133.07 75.68 1.64 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -175.21 -172.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.837 0.351 . . . . 0.0 111.813 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.519 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -166.62 96.31 0.55 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.365 179.725 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 pp -151.92 173.31 14.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.443 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -107.06 163.71 12.76 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.134 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -143.11 161.42 38.24 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.022 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -148.05 126.94 12.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -134.99 138.5 48.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.185 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -102.02 106.4 17.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.497 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -108.92 140.0 43.0 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.994 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.4 m . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.928 -179.728 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.233 0.198 0 CA-C-O 120.658 0.266 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -146.54 146.23 30.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -99.95 130.79 46.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.417 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -122.75 127.03 48.65 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.292 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.0 tt -100.94 107.2 18.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.382 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -99.83 105.03 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.503 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.9 p -88.95 116.53 27.31 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.847 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -100.25 140.57 34.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.078 0.465 . . . . 0.0 111.82 -179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.416 HG22 HG11 ' A' ' 86' ' ' VAL . 27.3 mt -144.57 101.2 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.653 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.33 124.52 9.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.261 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -33.07 -46.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.692 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.0 m-80 -56.05 -10.92 0.92 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.416 HG11 HG22 ' A' ' 82' ' ' ILE . 12.5 p -51.98 125.68 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.998 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.09 162.84 28.58 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.64 -50.7 52.61 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.813 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.29 -39.51 87.16 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.772 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.463 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 71.6 mm-40 -61.95 -44.58 96.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -57.06 -48.12 79.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.743 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.41 -44.72 89.16 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.647 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -56.58 -54.58 44.28 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.291 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -48.74 -40.17 27.61 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.489 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.26 -52.37 53.0 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.963 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.5 -37.48 86.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.305 . . . . 0.0 110.786 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -70.06 -35.7 74.42 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.195 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -31.79 71.94 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.299 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.0 t -81.02 -33.33 33.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.951 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.0 mt -64.22 -43.81 93.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 39.6 t -68.02 -42.53 85.38 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -37.41 76.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.0 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.12 -42.51 93.87 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.761 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 43.4 t -69.58 -41.34 80.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.909 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 36.3 t -114.1 97.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.949 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -96.18 -22.24 17.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.567 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.6 80.44 5.98 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.965 0.412 . . . . 0.0 110.514 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -129.27 172.91 11.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.734 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.34 -53.95 2.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.531 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.1 125.57 13.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.776 0.322 . . . . 0.0 111.494 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.43 128.35 47.95 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.557 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -144.1 161.75 38.01 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.987 0.422 . . . . 0.0 111.514 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.6 t -100.81 141.99 16.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.392 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.402 HG21 ' N ' ' A' ' 120' ' ' LEU . 31.7 mt -135.94 135.78 50.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 21.3 t -118.58 -15.98 9.51 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.991 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -115.0 151.89 33.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 111.03 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -21.96 66.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.354 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -55.8 22.11 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.576 0.227 . . . . 0.0 110.792 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.452 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 0.6 OUTLIER -73.88 -30.03 62.4 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.402 ' N ' HG21 ' A' ' 114' ' ' ILE . 0.9 OUTLIER -68.72 -25.85 64.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.689 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.04 136.98 56.32 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -53.21 -29.94 34.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.924 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -59.91 -47.16 86.92 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.945 0.402 . . . . 0.0 110.425 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.452 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 30.8 t80 -68.21 -48.36 65.42 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.862 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 59.6 mt -54.61 -43.74 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -43.29 80.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.179 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -47.54 76.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.819 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.63 -42.83 97.7 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.118 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.2 tt -70.23 -31.97 69.63 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.249 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.53 0.191 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.738 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 t . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 120.718 0.294 . . . . 0.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.2 mttp -99.51 151.42 21.17 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.065 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.509 HG13 ' HB ' ' A' ' 36' ' ' ILE . 3.8 tt -116.71 128.96 73.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.37 106.67 16.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -58.57 -37.34 75.54 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.215 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.27 -49.81 76.41 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.912 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HB2' HG22 ' A' ' 37' ' ' VAL . . . -63.56 -53.89 44.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.307 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -53.54 -43.04 68.09 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.187 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -68.78 -43.07 76.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.64 -45.97 73.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.52 -48.39 75.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.84 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -53.39 -46.57 69.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.855 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -57.52 -43.52 84.36 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.019 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.28 -40.84 81.72 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.077 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 42.8 t -64.69 -42.01 93.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.842 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.6 -41.27 80.9 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.631 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.233 0.234 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.641 179.528 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.315 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.9 t -124.89 114.31 39.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 111.22 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.424 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -107.41 -30.16 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.434 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -131.27 154.87 48.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.878 0.371 . . . . 0.0 111.173 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 34.2 m -142.17 146.77 22.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.261 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.22 170.71 9.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.995 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -148.56 98.96 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.36 179.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.26 -179.57 3.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.013 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 35.2 p90 -140.8 128.56 21.67 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.023 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -96.9 107.16 19.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.397 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.59 -77.56 1.07 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.161 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.72 38.31 0.47 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.753 0.311 . . . . 0.0 111.359 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.6 t -140.77 122.73 15.52 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.898 0.38 . . . . 0.0 110.987 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.509 ' HB ' HG13 ' A' ' 5' ' ' ILE . 4.0 mm -79.47 133.44 29.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.94 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.482 HG22 ' HB2' ' A' ' 9' ' ' ALA . 9.8 p -157.09 139.0 10.11 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.005 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.427 ' HD2' ' CB ' ' A' ' 9' ' ' ALA . 15.6 Cg_endo -56.34 162.75 7.39 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.61 2.207 . . . . 0.0 112.329 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -127.06 -157.96 9.66 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.387 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.5 mp0 -32.63 139.11 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.782 0.833 . . . . 0.0 112.611 -179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -136.4 91.78 2.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.408 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.18 168.5 21.44 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 113.317 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -94.21 -15.23 24.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.754 -0.223 . . . . 0.0 111.187 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -96.72 129.61 44.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -78.42 -17.09 56.88 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.717 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -49.76 -40.57 41.61 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.765 0.317 . . . . 0.0 110.601 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.91 -36.17 81.65 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.928 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -60.7 -46.7 89.38 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.761 0.315 . . . . 0.0 110.788 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 25.1 mt -63.94 -41.47 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -70.42 -40.05 74.07 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.715 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.16 -42.01 69.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.535 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -73.71 81.91 1.57 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.921 0.391 . . . . 0.0 111.265 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 p -117.4 155.83 28.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.56 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.447 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 7.2 m-20 -72.33 69.53 0.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.203 0.525 . . . . 0.0 110.95 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.716 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.5 t70 -170.03 46.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.098 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.404 ' H ' ' HA3' ' A' ' 83' ' ' GLY . 0.0 OUTLIER -175.66 -171.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.885 0.374 . . . . 0.0 111.935 -178.457 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.489 ' HB3' ' CG1' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -160.99 94.51 1.02 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.565 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 177.11 11.58 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.849 0.357 . . . . 0.0 111.675 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.422 ' CE1' ' HB3' ' A' ' 97' ' ' ASP . 28.7 m-85 -109.74 163.43 13.51 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.462 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.42 141.48 26.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.084 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -122.39 135.42 54.69 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.021 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -137.24 136.17 47.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.179 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -101.76 127.1 48.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.826 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -107.56 151.22 25.89 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.184 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.155 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.658 0.266 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -137.9 144.03 41.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.891 0.377 . . . . 0.0 111.402 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -94.0 134.99 35.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.795 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -135.95 106.27 6.41 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.892 0.377 . . . . 0.0 111.429 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tt -96.35 117.05 30.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.41 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.449 HG22 ' CD2' ' A' ' 120' ' ' LEU . 2.1 mp -118.87 119.94 62.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 120.878 0.37 . . . . 0.0 111.345 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.5 m -88.08 138.58 31.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.235 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.5 t-105 -115.54 125.98 53.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.912 0.387 . . . . 0.0 111.192 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.3 tt -123.59 81.4 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.523 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.447 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -62.48 126.05 36.89 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.572 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.444 ' C ' ' H ' ' A' ' 86' ' ' VAL . 6.2 mm-40 -29.62 -34.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.716 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.7 m-80 -73.93 39.64 0.11 Allowed 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.489 ' CG1' ' HB3' ' A' ' 57' ' ' ARG . 4.7 m -96.46 112.08 27.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.505 178.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.9 170.15 16.8 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.154 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -46.03 -50.65 12.04 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.493 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.67 -35.94 81.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.625 0.212 . . . . 0.0 111.513 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.438 ' HG3' ' HG3' ' A' ' 57' ' ' ARG . 3.0 mp0 -65.09 -39.93 93.87 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.997 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -50.68 -50.42 54.88 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.837 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.22 -38.58 68.96 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -55.33 -40.68 71.48 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.366 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.5 m -53.26 -46.91 69.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.151 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.06 -50.4 65.78 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.001 -0.618 . . . . 0.0 112.624 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.5 p -62.66 -41.22 98.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.562 0.22 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.422 ' HB3' ' CE1' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -66.64 -40.87 88.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.09 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -30.21 68.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.772 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.5 m -71.9 -42.68 66.46 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.774 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -56.52 -56.07 25.88 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.19 -36.55 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.963 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -45.1 89.94 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.907 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.07 -38.05 84.86 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 20.3 t -73.74 -43.54 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.35 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.89 100.25 10.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.926 0.393 . . . . 0.0 111.118 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -103.47 -29.34 11.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.573 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.78 83.81 4.9 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.14 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -138.19 -179.14 5.61 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.736 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -109.6 -67.19 1.0 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.387 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -134.87 144.57 47.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.41 137.05 43.74 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -155.66 173.98 15.95 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.101 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.41 141.01 45.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 30.8 mm -126.22 153.37 34.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.15 -179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 m -117.59 -24.74 7.16 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -117.81 146.81 43.58 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.941 0.4 . . . . 0.0 111.168 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -62.57 -28.04 69.6 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.594 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.87 -45.76 91.47 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.667 0.27 . . . . 0.0 110.886 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.55 -31.5 53.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.8 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.449 ' CD2' HG22 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -79.76 -2.23 42.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.732 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.07 132.23 53.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.931 0.396 . . . . 0.0 110.523 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.39 -37.76 49.93 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.609 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.5 -43.1 99.46 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.28 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -67.94 -51.54 46.43 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.834 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.437 HD11 ' O ' ' A' ' 120' ' ' LEU . 63.7 mt -57.71 -50.44 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -55.05 -42.09 72.27 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.185 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -40.69 94.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.045 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -63.14 -56.8 13.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.8 pp -63.81 -23.54 67.4 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.609 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.8 tttt . . . . . 0 CA--C 1.53 0.197 0 CA-C-O 120.421 0.153 . . . . 0.0 110.911 179.431 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 t . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.837 0.351 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -179.55 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.565 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -130.72 133.32 63.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.747 0.308 . . . . 0.0 111.16 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -83.13 96.17 8.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.37 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -59.83 -42.92 94.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.244 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.98 -49.81 74.62 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.323 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.404 ' CB ' HG22 ' A' ' 37' ' ' VAL . . . -70.27 -50.94 34.49 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 40.8 m -55.35 -42.9 74.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -66.11 -47.23 74.85 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.516 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.28 -44.19 71.68 Favored 'General case' 0 CA--C 1.527 0.06 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.894 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.62 -37.48 84.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.252 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -55.13 -60.07 3.89 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.15 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -63.96 -29.48 70.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.526 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.0 tt -62.55 -44.54 96.07 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.714 0.293 . . . . 0.0 110.603 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 52.3 t -68.2 -34.63 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.58 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -60.3 -35.99 76.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.412 179.335 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.485 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.2 p -118.34 117.77 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.519 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.55 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -121.57 -31.56 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.51 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 32.2 p-90 -130.87 158.42 40.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.951 0.405 . . . . 0.0 111.384 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 14.5 m -144.52 145.18 21.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.23 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 39' ' ' GLY . 16.7 p -105.7 100.23 9.8 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.812 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.47 ' HB2' ' O ' ' A' ' 59' ' ' PHE . 3.8 m-85 -78.89 109.62 13.34 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.666 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -128.45 135.58 49.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.593 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -91.69 123.7 35.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.98 123.33 45.69 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.715 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.1 -83.04 0.74 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.357 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.94 31.06 0.56 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.5 t -149.82 139.22 21.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.744 0.307 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 7.0 mt -85.09 137.77 20.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.901 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.404 HG22 ' CB ' ' A' ' 9' ' ' ALA . 10.0 p -155.15 141.26 12.96 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.499 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.433 ' HG3' ' CZ ' ' A' ' 29' ' ' PHE . 37.8 Cg_exo -57.56 154.34 36.92 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.555 2.17 . . . . 0.0 112.515 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -128.45 -155.74 8.75 Favored Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 121.325 -0.464 . . . . 0.0 112.082 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.568 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.5 mp0 -24.52 130.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.727 0.811 . . . . 0.0 112.643 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -131.69 98.13 4.4 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.32 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.85 164.33 24.98 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.482 -0.866 . . . . 0.0 113.32 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.55 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -89.67 -20.66 23.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.62 0.248 . . . . 0.0 110.889 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.81 126.49 37.91 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.795 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 12.9 t80 -70.79 -19.13 62.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.671 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -46.98 -41.94 17.12 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.745 0.307 . . . . 0.0 110.643 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.89 -36.68 82.83 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.937 178.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -58.68 -49.34 77.93 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.099 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.3 mt -70.85 -42.61 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.67 -45.43 94.16 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.027 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -76.39 -31.01 57.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.8 m -75.29 84.55 2.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.056 0.455 . . . . 0.0 111.5 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p -93.17 169.67 10.22 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.15 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -85.46 17.43 3.19 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.674 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -133.67 67.86 1.51 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.296 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.404 ' O ' ' N ' ' A' ' 83' ' ' GLY . 0.0 OUTLIER -177.35 -172.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.386 -179.096 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.409 ' HD3' HG11 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -159.06 114.91 2.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.778 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 pp -158.31 154.06 26.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.827 0.346 . . . . 0.0 111.537 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.47 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 1.5 m-85 -107.05 98.98 8.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.407 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -107.92 157.41 18.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.504 ' HB3' ' HA ' ' A' ' 78' ' ' LEU . 31.7 p90 -152.37 164.29 37.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.262 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.4 t -137.41 152.54 27.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.364 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -113.26 104.11 12.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.633 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -103.7 173.33 6.35 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.22 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.274 179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.761 0.315 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HD3' ' HB3' ' A' ' 109' ' ' ALA . 24.5 mttm -151.73 146.33 25.68 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.953 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -92.98 170.68 9.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.116 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -154.87 105.54 2.58 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.504 ' HA ' ' HB3' ' A' ' 61' ' ' PHE . 7.4 mt -80.99 134.64 35.73 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.203 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.4 mt -129.8 105.43 12.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.027 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.417 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.3 OUTLIER -80.23 97.04 6.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.208 179.601 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -89.22 135.03 33.79 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 41.4 mt -141.58 101.4 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.78 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 56' ' ' VAL . . . -68.08 117.06 8.17 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.026 -0.606 . . . . 0.0 112.221 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.468 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.2 mt-10 -32.04 -40.3 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -179.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.674 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.0 m-80 -71.28 42.0 0.07 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 111.942 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.468 ' H ' ' C ' ' A' ' 84' ' ' GLU . 2.7 m -95.49 135.2 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.491 178.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.16 164.49 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.47 83.47 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.024 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 tp -66.46 -32.14 73.32 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.622 0.211 . . . . 0.0 111.317 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -59.25 -40.21 85.25 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.959 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -40.45 80.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.18 -39.36 40.99 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -58.45 -46.32 86.79 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.011 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -42.28 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.193 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.43 -46.65 93.57 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.191 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.1 -43.13 68.32 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.646 0.26 . . . . 0.0 110.837 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.6 -38.79 88.88 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.422 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.73 -30.62 70.09 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.681 0.277 . . . . 0.0 110.664 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 23.3 m -71.54 -41.82 68.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.412 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.7 mt -63.33 -51.24 66.81 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.39 -30.58 49.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.312 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -65.55 -45.12 84.61 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.638 0.256 . . . . 0.0 110.676 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -38.69 81.99 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.831 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 26.2 t -78.26 -37.04 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.971 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -129.8 83.31 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.94 0.4 . . . . 0.0 110.751 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.0 -35.63 7.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.196 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.97 77.83 2.85 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.456 ' CD2' HD12 ' A' ' 78' ' ' LEU . 4.4 p90 -124.73 179.39 5.0 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.505 ' HB3' ' HD3' ' A' ' 75' ' ' LYS . . . -92.17 -59.36 2.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.5 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.85 154.29 51.22 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.751 0.31 . . . . 0.0 111.359 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -148.88 135.6 19.7 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.174 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -160.44 159.32 30.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.927 0.394 . . . . 0.0 111.292 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.417 HG12 ' HB ' ' A' ' 80' ' ' THR . 2.6 m -100.3 147.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.992 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 59.6 mt -142.18 140.62 29.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.956 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 54.6 m -140.49 31.57 1.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -145.8 134.57 22.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.488 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -34.06 74.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.948 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -69.08 -41.09 78.0 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.681 0.277 . . . . 0.0 110.485 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.71 -32.85 64.11 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.666 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -24.94 64.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.577 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.91 135.2 12.66 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.045 0.45 . . . . 0.0 111.336 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -50.79 -33.74 24.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.094 -179.538 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -38.34 73.22 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 110.309 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -76.14 -46.2 29.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.714 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 29.3 mm -60.19 -51.47 72.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.225 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.0 -42.79 95.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.684 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.1 t -62.78 -43.36 99.01 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.571 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.02 -42.44 90.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.092 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.2 tp -64.42 -43.14 95.29 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.446 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 32.7 tttp . . . . . 0 C--O 1.232 0.142 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.26 -179.807 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -88.62 150.81 22.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.072 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 tt -120.86 124.3 72.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.596 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.08 112.92 9.57 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.911 0.386 . . . . 0.0 110.806 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.24 -42.97 65.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.925 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -57.06 -51.45 69.22 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.019 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.437 ' HB2' ' HD2' ' A' ' 38' ' ' PRO . . . -61.15 -50.78 71.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.3 t -57.35 -44.24 84.13 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.211 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -42.0 91.31 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.827 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.35 -47.91 68.97 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.747 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.17 84.6 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.666 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -59.26 -37.58 77.95 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.124 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -69.98 -44.25 69.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.284 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -46.88 67.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.102 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.92 -24.91 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.39 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -39.84 66.68 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.881 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 C--O 1.234 0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.571 179.655 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.96 0.41 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.2 t -142.59 125.0 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.427 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -127.01 -29.28 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.405 ' HB2' HG21 ' A' ' 62' ' ' VAL . 32.7 p-90 -132.96 157.65 44.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.952 0.406 . . . . 0.0 111.727 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 2.3 t -139.07 150.52 23.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.255 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.7 m -90.99 159.97 15.87 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.492 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -145.29 93.16 2.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.208 0.528 . . . . 0.0 110.558 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -113.31 179.14 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -143.78 130.32 20.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.979 0.419 . . . . 0.0 111.427 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.8 -149.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.271 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.4 83.17 0.06 OUTLIER Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.558 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m 65.42 49.62 1.84 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.58 0.352 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.7 t -164.07 113.44 1.21 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.138 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 31.2 mt -85.68 139.75 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.6 m -156.57 154.5 27.04 Favored Pre-proline 0 C--O 1.233 0.185 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.28 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.437 ' HD2' ' HB2' ' A' ' 9' ' ' ALA . 44.7 Cg_endo -67.31 166.06 24.73 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.539 2.159 . . . . 0.0 112.255 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -139.1 -147.02 5.04 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.566 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.7 mp0 -31.96 133.33 0.1 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.356 0.662 . . . . 0.0 112.334 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -136.37 93.97 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.642 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.12 168.61 26.02 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.098 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -86.82 -19.44 28.99 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.573 0.225 . . . . 0.0 110.799 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -89.95 112.14 23.43 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -66.72 -23.1 66.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.768 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -48.7 -35.04 13.11 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.678 0.275 . . . . 0.0 110.792 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 -38.78 90.81 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.052 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -70.97 -38.9 72.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.576 0.227 . . . . 0.0 110.926 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.0 mt -62.93 -40.28 88.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.795 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -45.9 85.21 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.359 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -31.63 67.89 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.468 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.442 ' HB3' ' CD1' ' A' ' 120' ' ' LEU . 1.8 m -74.01 83.94 1.76 Allowed 'General case' 0 C--O 1.233 0.184 0 CA-C-O 120.971 0.415 . . . . 0.0 111.182 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.2 p -100.29 -176.97 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.075 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.25 18.08 2.31 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.853 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.537 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 47.9 t0 -144.09 79.59 1.62 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.854 0.359 . . . . 0.0 110.219 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -175.59 -175.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.39 -179.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.57 77.2 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.073 0.463 . . . . 0.0 110.671 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -132.38 170.95 14.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.463 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -106.2 174.88 5.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.48 157.76 42.74 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.255 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -135.3 121.09 19.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.799 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.405 HG21 ' HB2' ' A' ' 26' ' ' TRP . 16.2 t -135.77 127.24 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.102 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.16 118.45 26.58 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.471 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -106.3 154.14 21.18 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.863 0.364 . . . . 0.0 111.662 -179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.232 0.179 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.324 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.742 0.306 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.19 150.71 39.74 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.098 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.404 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 11.6 m-85 -105.55 116.97 32.84 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.002 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.09 123.62 50.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.822 0.344 . . . . 0.0 111.428 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.424 ' HB3' ' CB ' ' A' ' 111' ' ' GLU . 3.5 tp -98.18 104.65 16.7 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.337 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 38.6 mm -85.68 100.06 8.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 86.5 m -84.8 108.77 17.64 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.31 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 66.5 t-105 -95.29 138.78 32.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.967 0.413 . . . . 0.0 111.435 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.7 tt -141.1 88.02 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.831 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.46 123.37 33.13 Favored Glycine 0 C--N 1.336 0.563 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.442 ' C ' ' H ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -38.57 -39.83 0.52 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -178.282 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.9 m-80 -73.75 42.96 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.226 0.536 . . . . 0.0 111.549 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.442 ' H ' ' C ' ' A' ' 84' ' ' GLU . 8.1 p -96.59 135.61 30.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.766 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 m -71.33 157.87 37.34 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.89 -42.83 87.11 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.987 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mt -58.85 -43.11 90.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.638 0.256 . . . . 0.0 111.045 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.92 -33.78 76.34 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.194 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -52.74 33.57 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.975 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.47 -36.44 78.97 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 179.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -43.28 69.82 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -49.19 -46.83 46.11 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.16 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.62 -45.85 93.61 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.373 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 21.8 m -62.54 -46.57 87.79 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.71 0.29 . . . . 0.0 110.877 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.469 ' HA ' HD13 ' A' ' 100' ' ' LEU . 62.8 m-20 -61.03 -37.29 82.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -57.19 -34.09 68.15 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.709 0.29 . . . . 0.0 110.637 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.7 m -72.66 -43.39 63.23 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.624 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 97' ' ' ASP . 37.9 mt -58.31 -47.13 84.66 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 38.8 t -64.64 -38.28 82.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.873 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -38.18 90.14 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.97 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -63.74 -38.93 92.96 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.758 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 t -81.59 -42.86 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.046 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -108.75 102.72 14.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.904 0.383 . . . . 0.0 110.984 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mp0 -100.93 -28.86 12.53 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.339 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -80.57 78.7 7.28 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.006 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.404 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 26.1 p90 -133.88 160.47 37.57 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.6 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -97.94 -61.89 1.32 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.437 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.87 149.54 33.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.424 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -144.93 129.46 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -144.02 161.78 37.89 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.97 0.414 . . . . 0.0 111.261 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.433 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 14.5 p -101.18 140.79 19.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.034 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 15.9 mt -133.63 148.39 30.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.7 m -131.16 26.42 4.87 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.228 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -134.19 138.14 44.92 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.606 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -37.06 80.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.006 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -43.27 99.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -69.61 -31.56 69.75 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.613 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.442 ' CD1' ' HB3' ' A' ' 52' ' ' CYS . 17.1 mt -62.25 -31.96 72.59 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.969 179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -46.17 127.62 8.83 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -49.8 -41.65 45.06 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.647 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -56.2 -42.7 77.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.96 0.409 . . . . 0.0 110.278 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -64.51 -48.82 73.72 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 31.6 mt -59.26 -45.58 92.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -44.02 72.85 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.861 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.9 t -63.07 -43.16 99.37 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.744 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -52.23 65.5 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 mp -61.12 -31.88 71.58 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.717 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.954 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.755 0.312 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -129.39 170.13 14.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.151 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -124.48 129.38 73.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.683 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.468 ' HB2' HG12 ' A' ' 37' ' ' VAL . 4.7 m-20 -81.26 112.57 18.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -68.55 -40.98 80.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.753 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.52 -47.07 76.84 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.032 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.49 -54.15 18.73 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.266 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 m -52.86 -47.88 67.47 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.433 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -67.46 -38.62 84.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.07 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.34 -50.31 71.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.021 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.52 93.13 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.925 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -55.66 -44.51 77.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -57.44 -42.9 83.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.911 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -39.39 93.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.944 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.7 t -64.56 -35.15 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.129 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -38.03 63.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.048 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.544 179.486 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.977 0.417 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.89 107.07 5.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.948 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.1 pp -112.69 -29.58 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.742 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -127.31 160.22 32.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.998 0.427 . . . . 0.0 111.391 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.452 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 2.6 t -139.42 149.77 22.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.437 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 60.5 m -89.01 161.92 16.32 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -149.0 93.45 2.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.676 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 ptmm? -132.38 142.74 49.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -85.57 133.34 34.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.058 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.24 110.14 22.23 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.184 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.87 -71.08 2.79 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.932 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.4 p -162.36 30.52 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.585 0.231 . . . . 0.0 111.204 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.414 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 37.4 p -144.33 123.95 13.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.783 0.325 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.3 mp -72.73 130.08 35.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.85 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.468 HG12 ' HB2' ' A' ' 6' ' ' ASP . 10.6 m -151.78 145.7 18.01 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.35 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.413 ' HA ' ' O ' ' A' ' 28' ' ' THR . 29.2 Cg_exo -62.09 168.35 9.28 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.568 2.179 . . . . 0.0 112.46 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.437 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -140.33 -145.9 4.73 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.598 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.6 mp0 -34.22 137.92 0.1 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.353 0.661 . . . . 0.0 112.582 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.452 ' HG2' HG12 ' A' ' 27' ' ' VAL . 4.9 mt-30 -134.76 96.82 3.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.002 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.13 163.13 25.1 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.437 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.4 -22.37 26.62 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.719 -0.241 . . . . 0.0 110.927 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -94.8 113.38 25.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.129 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -64.36 -20.1 65.9 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -46.46 -38.59 9.37 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.704 0.287 . . . . 0.0 110.746 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -42.01 97.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.208 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -69.07 -39.46 79.09 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.685 0.278 . . . . 0.0 110.713 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 25.7 mt -63.63 -34.93 70.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.067 179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.29 -25.02 25.71 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.625 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -25.41 26.33 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.596 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.6 p -75.07 66.76 1.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.892 0.377 . . . . 0.0 111.513 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -72.73 149.72 43.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.914 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -80.56 56.06 2.5 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.453 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.588 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.0 OUTLIER -161.31 39.74 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.901 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -175.97 152.89 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.304 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.469 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -112.6 129.71 56.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.407 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 pp -160.47 175.1 13.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.037 0.446 . . . . 0.0 111.782 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -111.3 178.83 4.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.924 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.6 159.88 42.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.033 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.401 ' CZ ' HG12 ' A' ' 105' ' ' VAL . 1.3 t80 -149.02 118.66 6.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.835 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.4 p -149.97 139.4 15.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.791 0.329 . . . . 0.0 111.206 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 5.1 ptm180 -120.94 152.61 38.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -139.19 150.8 45.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.055 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.0 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.651 179.497 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.639 0.257 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmpp? -135.7 160.65 37.86 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.308 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.501 ' CD2' ' HB3' ' A' ' 63' ' ' ARG . 81.8 m-85 -112.02 163.12 14.63 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.1 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.92 126.58 10.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.354 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.459 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 4.6 mp -100.14 112.92 25.24 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.322 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 16.4 mt -104.11 139.6 24.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.387 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.2 m -109.23 125.86 52.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.296 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -110.11 141.79 42.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.962 0.41 . . . . 0.0 111.562 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.4 mt -139.59 101.88 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.888 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -75.03 90.45 0.79 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 113.832 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 19.09 -73.15 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 178.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.588 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 21.1 m-80 -41.58 -26.46 0.07 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.072 0.549 . . . . 0.0 112.183 -178.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.452 HG23 ' HB3' ' A' ' 57' ' ' ARG . 16.6 t -44.62 104.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 m -69.16 173.52 5.53 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.01 0.433 . . . . 0.0 111.909 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.97 -45.32 93.88 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.554 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -41.68 71.25 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.854 0.359 . . . . 0.0 110.65 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.469 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.8 mp0 -65.85 -36.34 83.19 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.542 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -46.8 81.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.485 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.35 98.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.504 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -59.06 -38.6 79.76 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.59 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 28.6 m -63.89 -39.47 94.27 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.719 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -60.89 -46.21 94.99 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.331 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -40.99 98.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.601 0.239 . . . . 0.0 110.649 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -65.91 -38.0 87.55 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.889 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -56.86 -33.67 67.05 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.783 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.5 m -74.83 -41.39 59.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.432 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.76 -46.06 91.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.016 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 23.3 t -66.14 -40.87 88.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.769 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -57.2 -42.38 81.15 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -65.32 -41.13 94.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.718 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 38.2 t -70.44 -48.86 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.977 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.401 HG12 ' CZ ' ' A' ' 61' ' ' PHE . 18.2 t -113.21 107.27 22.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -107.77 -22.44 12.47 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.853 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -75.69 79.43 2.65 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.827 0.346 . . . . 0.0 111.379 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -143.37 159.7 41.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.723 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -87.48 -58.86 2.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.162 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.6 pttp -150.18 172.63 15.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.275 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.459 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 10.3 pt-20 -153.93 150.44 28.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.226 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -160.18 165.99 30.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.229 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.4 p -108.39 145.34 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.251 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 40.9 mt -135.17 146.46 30.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.692 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.7 p -138.4 29.03 2.45 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.297 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -144.0 135.25 25.66 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.663 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -38.39 81.62 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -65.53 -46.76 78.31 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.703 0.287 . . . . 0.0 110.758 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -69.37 -30.33 68.3 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.76 -23.09 61.53 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.411 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -48.22 138.44 9.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.169 0.509 . . . . 0.0 111.795 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -36.69 34.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.054 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.57 -39.76 71.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.488 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -71.25 -46.3 61.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.087 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mt -61.94 -47.9 91.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.191 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -38.33 90.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.246 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.7 t -67.54 -43.48 80.63 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.554 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -64.52 -45.13 88.56 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.106 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -34.1 75.78 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.33 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.53 0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.387 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.92 0.39 . . . . 0.0 110.778 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -111.24 176.87 4.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.821 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tt -134.22 128.47 52.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.027 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -81.5 94.73 6.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 1.4 mttm -60.99 -45.31 95.3 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.268 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -54.39 -44.99 72.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.094 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.414 ' CB ' HG22 ' A' ' 37' ' ' VAL . . . -73.15 -50.47 22.49 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.365 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 m -56.11 -43.69 78.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.28 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -69.68 -46.47 65.99 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.44 -43.83 62.15 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.69 0.281 . . . . 0.0 111.155 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.35 -36.4 66.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -58.82 -55.86 29.63 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.897 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -67.53 -31.66 71.91 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.84 -49.77 55.59 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.654 0.264 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.6 t -69.0 -23.79 27.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -52.5 -36.74 55.88 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.233 0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.285 179.273 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.298 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 p -125.71 118.21 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.875 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.63 -33.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.449 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.7 p-90 -131.77 157.68 43.19 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.963 0.411 . . . . 0.0 111.041 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.493 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 17.4 m -145.83 151.99 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.52 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.535 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 40.1 m -90.5 162.06 15.22 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.709 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -146.61 91.22 2.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.173 0.511 . . . . 0.0 110.461 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.91 165.54 14.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.912 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -103.13 123.18 46.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.06 0.457 . . . . 0.0 111.279 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.33 114.8 24.82 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.12 38.62 59.28 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.094 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.5 p 69.28 22.39 6.67 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.708 0.403 . . . . 0.0 111.758 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.7 p -136.58 130.46 32.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 0.0 111.24 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.4 mm -68.93 130.26 33.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.983 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.414 HG22 ' CB ' ' A' ' 9' ' ' ALA . 5.4 p -150.87 138.77 12.4 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.916 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -55.98 162.47 7.1 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.493 2.129 . . . . 0.0 112.579 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.535 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -133.05 -149.29 6.12 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.596 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.2 mp0 -37.08 137.51 0.34 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.322 0.649 . . . . 0.0 112.605 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -136.91 103.03 5.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.169 179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.27 164.52 26.9 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.268 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.23 -22.64 35.76 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.675 0.274 . . . . 0.0 110.844 179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -94.92 110.51 22.39 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -66.86 -19.07 65.67 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.67 -37.76 29.96 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.687 0.28 . . . . 0.0 110.674 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -36.42 83.93 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.483 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.408 ' CZ ' ' SG ' ' A' ' 52' ' ' CYS . 61.4 t80 -67.47 -52.13 42.98 Favored 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.842 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.7 mt -59.09 -35.08 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.188 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.3 -47.03 74.92 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.315 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.73 -42.62 50.12 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.374 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.408 ' SG ' ' CZ ' ' A' ' 48' ' ' PHE . 4.5 m -77.02 80.55 3.55 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 111.15 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.4 p -108.82 173.09 6.47 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.77 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.605 ' HB3' ' HB2' ' A' ' 84' ' ' GLU . 12.4 m-20 -75.2 69.05 2.02 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.029 0.442 . . . . 0.0 111.284 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.408 ' HA ' ' OD1' ' A' ' 85' ' ' ASN . 1.3 t70 -178.55 47.7 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.329 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.453 ' H ' ' HA3' ' A' ' 83' ' ' GLY . 0.0 OUTLIER -177.26 -175.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.914 -179.21 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.48 113.08 3.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.698 0.285 . . . . 0.0 111.224 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.4 pp -160.61 170.91 19.89 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.9 0.381 . . . . 0.0 111.637 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -105.65 179.36 4.29 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.722 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.0 172.64 17.17 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.814 0.34 . . . . 0.0 111.576 -179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.414 ' CE2' HG11 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -148.33 133.91 18.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.183 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.405 HG23 ' HB2' ' A' ' 26' ' ' TRP . 15.6 t -143.74 133.25 20.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.21 112.43 25.1 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.485 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -98.26 146.94 25.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.952 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.1 m . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.763 179.695 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.8 t . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.868 0.366 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.05 129.64 16.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.805 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -85.5 126.7 34.04 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.595 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.21 129.33 39.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.479 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.44 141.84 29.25 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.218 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 27.2 mt -125.35 122.16 62.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.128 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.403 ' HB ' HG12 ' A' ' 113' ' ' VAL . 7.3 m -104.92 105.9 16.15 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.11 179.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -88.98 121.93 31.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.93 0.395 . . . . 0.0 111.523 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 tt -111.38 100.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.706 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.453 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -67.97 83.8 0.17 Allowed Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.825 -0.625 . . . . 0.0 114.109 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.605 ' HB2' ' HB3' ' A' ' 54' ' ' ASP . 2.3 mm-40 19.6 -81.34 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 178.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.408 ' OD1' ' HA ' ' A' ' 55' ' ' ASP . 5.6 p30 -66.51 30.83 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -177.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.441 ' H ' ' C ' ' A' ' 84' ' ' GLU . 3.0 m -64.3 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 161.46 0.5 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.92 -48.63 57.4 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.484 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.55 -33.27 72.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.696 0.284 . . . . 0.0 110.947 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -70.88 -44.78 65.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.314 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -57.69 -47.95 80.92 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.813 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.6 -39.3 93.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.892 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.13 -39.42 86.21 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.063 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -40.8 71.11 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.546 0.212 . . . . 0.0 110.656 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.14 -50.27 57.91 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.595 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -45.84 83.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.87 0.335 . . . . 0.0 110.894 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.465 ' HA ' HD13 ' A' ' 100' ' ' LEU . 74.0 m-20 -60.71 -36.95 80.09 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.262 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -59.44 -33.25 71.04 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.577 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.8 m -68.8 -44.53 73.37 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.454 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 97' ' ' ASP . 12.3 mt -61.77 -45.72 92.67 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 104' ' ' VAL . 38.7 t -65.06 -33.1 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.889 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.71 -32.59 73.99 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.19 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.77 -55.06 10.89 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.823 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 101' ' ' VAL . 6.9 m -63.28 -33.89 63.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.614 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.414 HG11 ' CE2' ' A' ' 61' ' ' PHE . 42.1 t -108.82 101.46 12.59 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.496 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -104.3 -33.68 8.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.621 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -78.95 73.19 5.49 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.2 p90 -126.5 156.68 40.35 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.972 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.25 -49.07 4.84 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.277 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.13 141.15 6.73 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.022 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -135.44 149.99 49.73 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -159.9 159.84 32.85 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.707 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.403 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.7 m -89.43 153.09 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.979 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 60.8 mt -136.88 131.48 46.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.886 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -125.57 33.02 5.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.257 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -166.86 153.53 8.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.088 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.2 ptt85 -68.58 -24.61 64.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.872 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -63.57 -56.94 12.01 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.67 0.271 . . . . 0.0 110.849 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -72.17 -24.43 61.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.353 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.4 tp -74.33 -25.07 59.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.614 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -52.51 130.76 32.68 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.069 0.461 . . . . 0.0 111.069 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -51.1 -40.6 58.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.899 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.04 -41.74 98.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.897 0.38 . . . . 0.0 110.442 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -63.2 -48.72 77.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.089 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 6.9 mt -56.65 -48.07 81.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.007 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.79 -44.98 78.28 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.098 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -39.44 91.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.878 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -59.63 -53.31 59.57 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.018 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.7 pp -69.84 -24.79 63.5 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.744 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? . . . . . 0 N--CA 1.464 0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 111.12 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.737 0.303 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -85.25 145.97 27.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -115.76 125.55 72.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.413 ' HB3' HG11 ' A' ' 37' ' ' VAL . 7.6 t0 -81.97 109.36 16.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.555 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -69.1 -36.89 78.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.97 -47.83 60.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.67 -54.1 50.06 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.888 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.4 m -59.74 -39.0 83.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -60.1 -54.36 46.88 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.44 76.91 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.233 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -49.12 77.48 Favored 'General case' 0 C--N 1.334 -0.072 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.19 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -55.15 -46.28 75.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.49 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 66.6 m-20 -65.49 -26.91 68.13 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.437 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 tp -80.55 -38.54 29.39 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.058 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.4 t -70.33 -38.31 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.94 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 5.5 ptt180 -61.86 -28.19 69.32 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.15 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.3 t70 . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.588 179.663 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.193 0 CA-C-O 121.017 0.436 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.0 t -133.25 119.77 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.076 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.549 HG12 ' HA ' ' A' ' 43' ' ' ALA . 30.4 pt -120.69 -40.21 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.477 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.1 p-90 -122.91 158.43 30.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.872 0.367 . . . . 0.0 111.477 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 19.4 m -140.55 143.67 28.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.935 179.145 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.41 ' O ' ' N ' ' A' ' 39' ' ' GLY . 3.2 p -102.28 97.29 7.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.994 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 6.0 m-85 -79.45 114.66 18.56 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.938 0.399 . . . . 0.0 110.611 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.16 162.17 34.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.695 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.416 ' HA ' ' O ' ' A' ' 35' ' ' THR . 38.7 p90 -111.04 121.61 45.79 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.039 0.447 . . . . 0.0 111.579 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.16 107.01 18.9 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.103 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.33 -78.71 1.42 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.278 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.4 m -151.65 33.97 0.55 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.601 0.239 . . . . 0.0 111.211 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.416 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 2.6 t -144.7 123.8 12.87 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 7.0 mt -84.88 126.08 40.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.158 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.413 HG11 ' HB3' ' A' ' 6' ' ' ASP . 5.9 m -148.6 156.91 41.88 Favored Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.519 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.431 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 37.0 Cg_endo -65.71 156.68 62.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.657 2.238 . . . . 0.0 112.295 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.41 -154.42 7.81 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.327 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.7 mp0 -27.59 132.69 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.681 0.792 . . . . 0.0 112.16 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.441 ' HG2' HG11 ' A' ' 27' ' ' VAL . 20.7 mt-30 -134.18 97.16 3.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.188 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.72 164.95 22.39 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.571 -0.823 . . . . 0.0 113.263 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.549 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.33 -17.28 24.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.743 -0.228 . . . . 0.0 111.055 179.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -92.65 129.49 38.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.673 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.488 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 23.8 t80 -77.89 -15.5 58.97 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -48.27 -41.64 28.41 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.721 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.59 -38.27 80.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.733 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -57.99 -45.78 86.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.08 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 47.7 mt -65.51 -46.18 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.995 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.97 -38.62 91.75 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.95 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 -30.93 58.79 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.73 74.57 3.39 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.808 0.337 . . . . 0.0 111.565 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -100.52 144.38 29.58 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.645 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.506 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.2 p-10 -76.05 64.96 2.0 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 111.642 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.73 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.7 t0 -168.44 44.71 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.97 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 174.66 -176.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.448 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -140.21 112.86 8.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.447 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.89 139.54 26.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.946 0.403 . . . . 0.0 111.466 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -85.69 141.53 29.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.105 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.26 113.33 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.809 0.338 . . . . 0.0 111.202 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.4 ' CB ' ' HA ' ' A' ' 78' ' ' LEU . 16.8 p90 -116.08 156.13 26.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.723 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -137.75 149.81 25.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.085 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -107.75 112.43 25.09 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.705 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -111.58 137.61 49.2 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.0 t . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.511 179.451 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.841 0.353 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -118.41 141.69 48.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.608 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -100.79 138.8 37.36 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.771 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -147.32 119.82 8.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.329 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.434 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 2.3 mp -92.87 118.6 31.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.546 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.42 HD12 ' CD1' ' A' ' 125' ' ' ILE . 4.3 mt -114.92 100.02 9.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.081 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.06 120.97 24.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.403 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -98.96 130.28 45.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.194 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.7 tt -129.99 96.43 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.104 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -69.27 108.79 2.6 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.805 179.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.466 ' C ' ' H ' ' A' ' 86' ' ' VAL . 3.7 mm-40 -34.39 -38.97 0.07 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.73 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 5.6 m-80 -73.15 43.29 0.12 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.391 0.615 . . . . 0.0 111.382 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.466 ' H ' ' C ' ' A' ' 84' ' ' GLU . 8.6 p -100.94 136.02 34.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.347 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 m -66.55 155.09 38.68 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.18 42.89 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.183 -0.532 . . . . 0.0 113.061 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt -56.89 -43.66 81.51 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.631 0.253 . . . . 0.0 110.922 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.59 -39.04 92.44 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.799 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -49.21 69.57 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.099 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.49 95.12 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.947 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -57.5 -41.95 81.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.7 m -59.09 -43.95 91.88 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.842 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.7 67.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.091 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.8 m -67.6 -37.9 83.22 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.565 0.221 . . . . 0.0 110.7 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.421 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 t70 -57.77 -41.95 83.08 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -30.37 68.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.278 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 m -70.79 -42.69 70.01 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.794 0.33 . . . . 0.0 110.747 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 97' ' ' ASP . 11.2 mt -62.92 -50.93 68.89 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.06 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.452 ' HA ' HG12 ' A' ' 104' ' ' VAL . 14.3 p -59.7 -30.2 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.049 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -67.35 -39.52 85.77 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.793 0.33 . . . . 0.0 110.617 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.74 -35.01 79.18 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.994 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.452 HG12 ' HA ' ' A' ' 101' ' ' VAL . 14.8 p -87.06 -31.5 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.634 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 40.8 t -113.38 97.71 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.846 0.355 . . . . 0.0 110.894 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.45 -34.32 6.56 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.689 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.75 84.1 2.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.987 0.422 . . . . 0.0 110.83 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -138.06 164.95 27.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.806 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.95 -48.05 5.03 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -156.55 139.31 15.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.821 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 9.1 pt-20 -135.86 135.25 39.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -151.56 159.5 44.08 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.104 0.478 . . . . 0.0 111.534 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.4 t -103.94 139.72 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.373 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 47.5 mm -134.86 149.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.069 0.461 . . . . 0.0 111.489 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 8.6 t -119.05 -25.75 6.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.493 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -88.68 146.22 25.19 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.925 0.393 . . . . 0.0 110.895 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.42 ' HA ' ' CD1' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -69.37 -29.76 67.61 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.668 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.4 -32.96 43.11 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.243 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.433 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 0.5 OUTLIER -75.4 -29.28 59.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.621 -179.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.42 ' CD1' ' HA ' ' A' ' 117' ' ' ARG . 0.0 OUTLIER -95.9 -13.47 23.91 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 153.27 4.65 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 121.145 0.498 . . . . 0.0 111.592 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.488 ' HB2' ' CD2' ' A' ' 45' ' ' TYR . 1.8 tt0 -54.66 -37.54 65.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.895 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -42.1 93.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.84 0.353 . . . . 0.0 110.207 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.433 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 12.2 t80 -70.41 -41.8 72.49 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.0 179.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.444 HD11 ' HA ' ' A' ' 122' ' ' GLU . 23.8 mt -61.24 -57.58 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.125 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -38.2 74.47 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.415 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.9 t -70.41 -48.64 55.16 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.994 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.14 -44.88 94.29 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.653 0.263 . . . . 0.0 111.074 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -37.38 79.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.577 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.7 tttp . . . . . 0 C--O 1.232 0.176 0 N-CA-C 111.639 0.236 . . . . 0.0 111.639 -179.302 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.819 0.342 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.18 127.71 32.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.517 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -138.82 151.26 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -113.22 127.85 70.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.954 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -80.44 108.91 14.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.52 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -37.38 86.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.209 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -62.76 -54.01 45.61 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.201 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.47 ' HB3' ' HD2' ' A' ' 38' ' ' PRO . . . -61.97 -51.84 66.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.163 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 m -54.45 -43.04 71.29 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.881 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -67.73 -42.43 81.9 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.799 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.96 -51.95 64.55 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.98 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.54 -42.35 98.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.926 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.32 -45.22 80.43 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.844 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -57.67 -42.9 84.54 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.092 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -44.79 91.6 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.888 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.2 t -62.93 -33.87 63.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -60.12 -34.79 74.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.69 122.04 24.13 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.567 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -103.21 29.44 5.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.898 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -29.51 4.79 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.911 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.56 171.53 8.96 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.924 0.393 . . . . 0.0 111.362 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.47 56.89 3.45 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.045 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.4 t -140.76 122.9 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.683 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -126.18 -39.41 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 35.9 p-90 -117.44 154.88 30.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.479 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 16.3 m -141.73 146.68 22.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.081 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.428 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 0.2 OUTLIER -88.17 168.59 12.63 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.221 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -148.39 100.77 3.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.283 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.48 155.13 50.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.687 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.8 p90 -106.03 133.2 51.13 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.017 0.437 . . . . 0.0 111.498 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -108.8 120.3 42.08 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.193 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.34 -74.56 1.68 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.227 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.6 37.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.779 0.323 . . . . 0.0 111.227 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.1 t -154.22 131.77 11.36 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.812 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.0 mt -78.0 138.65 19.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.466 HG22 ' HB3' ' A' ' 9' ' ' ALA . 7.1 p -153.6 140.33 12.9 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 9' ' ' ALA . 16.6 Cg_endo -57.12 161.83 10.36 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.603 2.202 . . . . 0.0 112.292 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.428 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.64 -151.26 7.23 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.632 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.0 mp0 -34.73 140.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.619 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -137.78 97.77 3.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.357 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.79 165.64 25.83 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.598 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.06 -23.14 33.29 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.643 0.258 . . . . 0.0 110.671 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -86.47 106.97 17.85 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.824 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -68.76 -21.08 64.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.525 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -48.04 -38.38 17.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.816 0.341 . . . . 0.0 110.675 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.67 -40.62 95.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.23 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 60' ' ' ALA . 48.1 t80 -65.52 -43.6 89.55 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.142 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 6.4 mt -59.72 -42.88 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.361 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.11 -37.81 69.43 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.608 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -38.94 67.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.385 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.418 ' SG ' HD13 ' A' ' 58' ' ' LEU . 5.6 m -86.69 80.4 8.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.637 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.52 161.75 13.47 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.436 ' HA ' ' CA ' ' A' ' 83' ' ' GLY . 3.1 p-10 -72.84 69.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 111.218 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.752 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.0 OUTLIER -168.07 41.17 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.427 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.48 ' O ' ' N ' ' A' ' 83' ' ' GLY . 0.0 OUTLIER 174.97 -172.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.587 -179.335 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.5 122.77 9.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.632 0.253 . . . . 0.0 110.525 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.418 HD13 ' SG ' ' A' ' 52' ' ' CYS . 3.0 pp -153.84 174.05 15.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.048 0.451 . . . . 0.0 111.673 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -107.46 171.75 7.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.691 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.422 ' HB3' ' CE2' ' A' ' 48' ' ' PHE . . . -155.3 162.33 40.89 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.425 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -150.15 107.17 3.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.778 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.9 t -126.18 136.18 61.58 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.028 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -109.84 136.51 49.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.605 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -121.8 144.82 48.59 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.347 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.04 118.02 35.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.97 91.12 3.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.678 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.46 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.3 158.91 30.33 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.593 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -159.84 79.78 0.7 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.916 0.389 . . . . 0.0 111.201 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.02 34.41 2.01 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.123 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -41.54 0.16 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.665 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 t -158.5 82.17 0.82 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.46 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 4.5 mtmt -79.81 110.29 15.03 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.726 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 155.21 44.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.367 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.97 169.2 8.57 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.114 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 136.93 11.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.738 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -84.12 152.64 24.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.427 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -151.29 116.11 5.2 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.81 110.38 22.76 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.489 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.6 mp -104.79 126.24 59.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.329 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.9 106.9 16.64 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.35 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -91.88 132.95 36.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.25 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.6 pt -138.52 84.76 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.023 0.44 . . . . 0.0 111.517 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.48 ' N ' ' O ' ' A' ' 56' ' ' VAL . . . -59.12 130.93 51.52 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.974 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.462 ' C ' ' H ' ' A' ' 86' ' ' VAL . 12.5 mt-10 -30.35 -30.91 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.752 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -75.28 36.64 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.565 0.62 . . . . 0.0 111.719 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.462 ' H ' ' C ' ' A' ' 84' ' ' GLU . 98.1 t -88.61 107.46 17.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.293 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -65.26 165.3 11.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.806 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.38 -47.47 50.71 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.918 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -42.63 99.13 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.598 0.237 . . . . 0.0 110.981 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.459 ' HB3' HG13 ' A' ' 86' ' ' VAL . 2.2 mp0 -70.67 -35.1 72.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.073 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -57.08 -53.69 55.19 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.606 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.87 73.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -61.01 -36.69 80.17 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.102 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.6 m -55.64 -52.3 64.29 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.44 0.162 . . . . 0.0 111.006 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.63 -43.89 98.67 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.339 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.4 m -63.35 -47.41 82.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.77 0.319 . . . . 0.0 110.642 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.58 -37.47 81.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.272 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -32.23 70.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.754 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.0 m -72.35 -41.55 66.33 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.461 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.7 mt -60.13 -50.19 74.67 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 26.4 t -64.33 -36.81 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.0 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.17 -44.82 71.82 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -38.52 70.42 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.749 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.6 t -58.84 -45.96 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.799 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' A' ' 108' ' ' PHE . 39.7 t -96.21 96.18 5.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.62 -33.18 53.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.424 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -111.13 95.97 5.86 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.401 ' HB3' HG12 ' A' ' 105' ' ' VAL . 23.2 p90 -126.04 178.36 5.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.111 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.19 -54.9 1.99 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.214 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -151.05 132.04 14.26 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.801 0.334 . . . . 0.0 111.452 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -136.6 125.24 23.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.508 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -152.17 161.95 41.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.009 0.433 . . . . 0.0 111.436 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 22.8 t -93.35 149.25 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 42.7 mt -137.19 140.58 42.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.71 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 18.1 p -128.34 23.53 5.95 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.358 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -143.77 137.58 28.17 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.7 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.52 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 6.6 ttp180 -61.74 -37.02 82.68 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.329 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -70.74 -33.64 71.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.404 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.415 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 8.6 mt-10 -76.8 -30.61 56.5 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.078 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.52 ' CD2' ' HA ' ' A' ' 117' ' ' ARG . 2.6 pp -88.58 -7.41 56.49 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.207 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -54.5 152.64 6.46 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.171 0.51 . . . . 0.0 110.76 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -55.45 -42.28 74.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.27 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.44 ' HB2' ' HB ' ' A' ' 141' ' ' THR . 0.4 OUTLIER -63.99 -31.0 72.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.697 -179.372 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.415 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 11.8 t80 -75.5 -46.21 33.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.97 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 22.9 mt -58.96 -53.58 45.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -58.59 -35.27 72.14 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.5 t -60.47 -48.0 83.69 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.655 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.53 -41.72 95.03 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.93 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.0 mt -68.39 -43.42 77.31 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.244 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -64.11 -48.16 77.19 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.385 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -72.05 -65.29 0.79 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.959 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 52.8 38.16 25.85 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.792 0.33 . . . . 0.0 111.424 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 128.69 55.52 0.11 Allowed Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.419 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -103.8 -168.35 25.3 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.448 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -101.24 34.29 2.6 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.71 0.29 . . . . 0.0 111.392 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 48.61 42.1 18.6 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.553 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -92.65 54.31 2.22 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.985 0.421 . . . . 0.0 111.161 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -118.75 153.92 33.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -147.62 -56.49 0.24 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.079 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -107.88 16.63 23.33 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.916 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' THR . . . . . 0.44 ' HB ' ' HB2' ' A' ' 123' ' ' ASN . 0.0 OUTLIER 52.58 44.57 29.91 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.353 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.626 0.251 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -99.2 112.46 24.61 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -111.87 145.13 40.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.139 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 16.2 tt -110.59 127.59 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.78 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -87.31 115.62 24.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.603 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -70.77 -45.29 65.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.287 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -59.46 -42.77 92.77 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.242 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.03 -56.09 11.57 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.893 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.5 t -55.47 -42.92 74.99 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.877 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -44.89 93.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.863 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.16 -46.9 69.08 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.037 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.15 -32.35 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.309 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.03 -56.43 21.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.649 0.261 . . . . 0.0 111.473 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -68.69 -24.55 64.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.21 -39.58 22.89 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.568 0.223 . . . . 0.0 111.53 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.463 ' HA ' HG11 ' A' ' 24' ' ' VAL . 9.9 p -71.93 -32.94 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.419 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -67.81 -23.97 65.24 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.203 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -65.21 98.74 0.34 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -27.84 67.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.092 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -57.41 -34.02 67.49 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.763 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -94.89 156.93 16.13 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB2' ' HB1' ' A' ' 43' ' ' ALA . . . -75.95 61.66 1.52 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.507 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.463 HG11 ' HA ' ' A' ' 17' ' ' VAL . 45.8 t -137.35 112.84 10.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.5 pp -125.36 -31.54 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.976 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.405 ' CZ3' ' O ' ' A' ' 40' ' ' GLU . 34.6 p-90 -122.91 159.49 28.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.43 . . . . 0.0 111.421 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 6.5 m -138.08 144.86 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.176 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.412 ' O ' ' N ' ' A' ' 39' ' ' GLY . 1.5 p -103.75 97.06 7.13 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.558 -179.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.491 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 10.8 m-85 -78.62 110.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 0.0 110.948 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -126.63 175.34 8.02 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.311 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -82.13 128.27 33.97 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.439 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.8 OUTLIER -96.37 69.01 2.61 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.083 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -13.77 10.13 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.284 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 169.51 -31.9 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.956 0.378 . . . . 0.0 111.104 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -91.88 177.18 6.26 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.663 0.268 . . . . 0.0 110.854 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.07 123.01 68.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.018 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.439 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 28.8 m -147.26 154.65 46.1 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.192 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.491 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 37.1 Cg_endo -66.27 161.37 40.83 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.519 2.146 . . . . 0.0 112.174 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -132.7 -151.07 6.59 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.092 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.483 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.6 mp0 -27.46 133.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.32 0.648 . . . . 0.0 111.993 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.438 ' HB3' HG13 ' A' ' 24' ' ' VAL . 11.0 mt-30 -128.74 99.05 5.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.351 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.86 23.95 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.402 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 23' ' ' ALA . . . -86.74 -25.0 24.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 110.837 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.44 118.53 30.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.508 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.407 ' CE2' HG22 ' A' ' 49' ' ' ILE . 13.1 t80 -66.83 -19.6 65.77 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.646 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.02 -40.24 10.28 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.069 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -37.19 86.54 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.272 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -70.37 -49.76 45.83 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.313 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.407 HG22 ' CE2' ' A' ' 45' ' ' TYR . 20.2 pt -59.42 -23.51 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.556 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.27 -27.44 18.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.304 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.07 -33.91 33.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.747 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.4 p -66.29 81.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.037 0.446 . . . . 0.0 111.844 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -90.82 153.16 20.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -88.24 62.17 6.59 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.997 0.427 . . . . 0.0 111.299 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.556 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.1 t0 -158.85 29.94 0.22 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.231 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 173.87 158.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.846 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.487 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -106.44 143.7 34.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.465 179.156 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 pp -160.04 147.37 16.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.458 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -86.04 169.57 13.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.945 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 154.86 36.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.467 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -149.71 114.52 5.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.541 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 16.5 t -124.92 144.18 35.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.152 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 143.91 45.76 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.971 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -128.56 158.16 39.22 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.001 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.6 t -134.13 94.84 3.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.586 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.4 p -90.28 108.84 20.01 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.831 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.619 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -155.53 138.74 6.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.975 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.49 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.5 OUTLIER -87.13 -178.12 6.17 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.601 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.77 17.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.49 ' H ' ' C ' ' A' ' 68' ' ' ASP . 22.9 ptm -123.21 -32.88 3.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.418 0.287 . . . . 0.0 111.549 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.88 171.76 19.86 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 120.636 0.255 . . . . 0.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.619 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -145.59 143.89 30.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.413 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.05 176.15 5.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.732 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -142.3 126.04 17.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.695 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm -119.49 162.97 17.99 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -132.53 131.67 41.82 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.816 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.422 ' CB ' HD13 ' A' ' 129' ' ' LEU . . . -130.24 121.05 25.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.169 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.36 100.14 10.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.257 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 12.3 mt -100.91 145.38 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.162 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.436 ' HB ' HG13 ' A' ' 113' ' ' VAL . 16.1 m -117.18 120.73 39.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.231 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -92.09 143.81 26.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.329 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 56.8 mt -139.56 111.1 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.129 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -89.44 107.4 3.4 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 113.376 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 7.56 -68.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 178.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.556 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 9.5 m-80 -42.38 -26.25 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.943 0.497 . . . . 0.0 111.925 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 74.3 t -54.06 100.19 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.291 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.7 p -75.33 -178.41 3.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.57 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.44 -47.72 62.06 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.184 -0.531 . . . . 0.0 112.639 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.1 mt -59.02 -46.59 87.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.714 0.293 . . . . 0.0 110.621 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.487 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 5.8 mp0 -65.59 -38.56 89.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.521 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -63.49 -39.61 94.89 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 -34.27 77.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.071 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -46.27 89.59 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -34.51 73.33 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.76 -51.68 54.0 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.966 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 m -64.34 -37.56 87.94 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.711 0.291 . . . . 0.0 110.665 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -60.56 -40.93 93.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.69 -32.11 68.84 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.574 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.8 m -69.42 -44.13 71.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.771 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.5 mt -62.07 -46.64 88.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.855 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.7 t -67.17 -33.36 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.165 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 ttpp -70.13 -38.39 75.53 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.955 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -30.67 69.22 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.9 p -92.7 -32.03 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.233 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 26.0 t -122.02 109.41 24.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.925 0.393 . . . . 0.0 110.867 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -18.53 13.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.762 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.04 79.66 2.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.764 0.316 . . . . 0.0 111.024 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -140.73 159.9 41.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.59 -55.17 2.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.45 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.7 150.05 51.52 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.777 0.322 . . . . 0.0 111.274 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.22 124.62 15.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.078 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -160.31 153.44 21.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.897 0.38 . . . . 0.0 111.366 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.436 HG13 ' HB ' ' A' ' 80' ' ' THR . 6.2 m -90.99 153.8 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.975 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 60.1 mt -139.56 142.18 33.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.928 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.21 25.87 3.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.383 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -139.14 139.39 37.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.888 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -67.21 -36.78 82.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.999 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -66.2 -45.37 81.01 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.548 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 -25.12 64.8 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.049 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.9 mt -73.56 -31.37 63.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.981 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -49.45 136.63 16.07 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.008 0.433 . . . . 0.0 111.385 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -31.08 7.28 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.143 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -59.74 -41.84 91.83 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 120.932 0.396 . . . . 0.0 110.261 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -76.78 -43.46 36.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.111 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 38.2 mm -60.53 -47.33 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.255 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -62.56 -32.84 73.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.3 t -68.91 -47.58 65.42 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.604 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -66.16 -39.94 90.17 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.135 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.422 HD13 ' CB ' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -61.57 -23.46 65.99 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.663 -179.937 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -56.93 -34.25 67.81 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.612 0.244 . . . . 0.0 111.26 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.39 -31.78 67.98 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.174 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.25 32.08 2.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.34 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -120.99 23.19 7.82 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.688 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.61 95.05 0.94 Allowed Glycine 0 C--N 1.335 0.513 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.195 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -171.65 26.46 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -164.68 26.41 0.06 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.737 0.303 . . . . 0.0 111.191 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.6 -30.1 65.43 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.715 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.78 144.17 39.41 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.944 0.402 . . . . 0.0 111.377 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -166.11 -47.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.216 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -92.98 14.09 18.7 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.802 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 4.6 m 61.85 92.99 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.307 179.958 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.682 0.277 . . . . 0.0 111.506 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 m -61.85 128.48 36.41 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.849 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -112.6 147.37 36.82 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.02 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.404 HG13 ' HB ' ' A' ' 36' ' ' ILE . 2.3 tt -109.42 126.98 66.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.52 107.96 13.76 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.509 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 2.2 mttt -63.03 -38.57 91.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.289 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.6 -52.44 65.41 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.143 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.532 ' HB3' ' HD2' ' A' ' 38' ' ' PRO . . . -63.14 -50.88 68.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.3 m -54.52 -43.43 71.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.117 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -61.35 -45.3 94.98 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.681 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.65 73.62 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.54 -52.01 67.01 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.963 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.23 -45.91 79.75 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.89 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -57.23 -46.22 83.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -43.35 83.99 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.062 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.1 t -65.84 -33.55 64.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.984 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -59.19 -38.91 81.01 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -80.4 127.99 33.04 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.309 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.7 40.09 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 45.98 0.73 Allowed Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.022 -0.608 . . . . 0.0 112.951 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -138.07 24.27 2.79 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 54.41 28.67 9.82 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.8 t -133.85 125.74 49.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-O 120.579 0.228 . . . . 0.0 110.929 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.2 pp -113.07 -31.0 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.823 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.458 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.0 p-90 -127.86 157.66 39.88 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 110.968 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.2 m -140.46 144.78 26.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.723 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.419 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 98.0 m -88.28 161.42 17.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.696 0.284 . . . . 0.0 110.908 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -144.64 97.17 2.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.99 0.424 . . . . 0.0 110.518 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.86 -178.63 4.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.97 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -112.97 118.27 34.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.001 0.429 . . . . 0.0 111.275 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.75 111.45 23.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.192 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.7 -75.41 1.84 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.237 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.27 35.41 0.17 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 111.069 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 t -155.68 140.73 17.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.404 ' HB ' HG13 ' A' ' 5' ' ' ILE . 33.5 mm -70.61 137.35 24.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.811 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.485 HG22 ' HB3' ' A' ' 9' ' ' ALA . 7.6 p -160.27 139.87 8.2 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.996 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.532 ' HD2' ' HB3' ' A' ' 9' ' ' ALA . 12.9 Cg_endo -55.28 152.7 30.53 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.822 2.348 . . . . 0.0 112.16 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.419 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -124.62 -150.35 7.83 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.746 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.458 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 17.6 mp0 -32.05 136.25 0.07 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.651 0.781 . . . . 0.0 112.727 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -136.85 97.49 3.54 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.328 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.22 168.94 25.58 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.773 -0.727 . . . . 0.0 113.461 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.77 -20.07 23.97 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.708 0.289 . . . . 0.0 110.618 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -93.24 128.62 39.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.541 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -76.83 -21.29 55.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.787 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -38.55 19.92 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.962 0.41 . . . . 0.0 110.489 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -37.5 87.44 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.401 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -69.33 -48.78 60.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.22 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.441 HG21 HD13 ' A' ' 49' ' ' ILE . 52.0 mt -62.1 -38.98 82.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.357 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.99 -41.07 87.38 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.673 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -34.01 46.41 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.69 84.95 3.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.9 p -85.85 169.62 13.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.188 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -83.79 17.87 2.17 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.699 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -134.27 65.08 1.58 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.787 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 170.25 143.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.625 -179.608 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.79 125.84 54.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.631 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 pp -153.81 171.93 18.14 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.019 0.437 . . . . 0.0 111.503 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -104.9 167.16 9.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.54 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -153.8 155.32 35.61 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.641 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.484 ' CE1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -145.55 119.16 9.13 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.1 t -128.35 144.37 38.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.951 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 mmt85 -100.44 105.33 16.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.613 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.429 ' CE1' HG21 ' A' ' 125' ' ' ILE . 28.5 m-85 -90.17 153.63 20.37 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.86 102.51 5.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.273 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -97.96 96.91 8.49 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.858 -179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.546 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.01 154.5 25.54 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.472 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.22 79.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.31 38.36 2.44 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.337 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -156.94 -37.69 0.08 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.313 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.0 p -157.74 79.04 0.86 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.918 0.39 . . . . 0.0 110.556 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.546 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -87.08 106.55 17.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.716 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 37.2 ttp180 -143.52 136.3 27.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p -87.38 161.03 18.13 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -143.17 149.89 38.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.02 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -106.39 118.83 37.66 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.417 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -129.53 119.23 23.35 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.251 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.5 ' HG ' ' HB3' ' A' ' 111' ' ' GLU . 0.5 OUTLIER -99.34 124.61 44.59 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.09 179.444 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mt -116.43 145.58 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.687 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -112.5 114.34 26.97 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.288 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -91.99 135.67 33.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.533 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mt -138.2 89.91 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.151 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.09 116.83 9.92 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.975 -0.631 . . . . 0.0 111.664 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.459 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.8 mt-10 -29.21 -40.31 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.699 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.4 m-80 -72.27 41.55 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.115 0.483 . . . . 0.0 111.985 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.459 ' H ' ' C ' ' A' ' 84' ' ' GLU . 20.1 t -107.71 122.76 62.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.11 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -72.4 164.45 26.33 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.85 0.357 . . . . 0.0 111.39 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.17 -44.32 57.2 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.022 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.33 -47.88 77.85 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.638 0.256 . . . . 0.0 110.896 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.21 -34.97 77.24 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.49 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -60.51 -45.18 94.73 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.89 87.59 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.776 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -53.25 -40.72 64.81 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.857 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 m -56.49 -41.92 77.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.173 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.95 -45.02 97.0 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.624 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -46.35 55.16 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.514 0.197 . . . . 0.0 111.251 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -64.11 -35.06 79.52 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.448 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -55.85 -36.66 67.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.877 0.37 . . . . 0.0 110.259 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.5 m -72.95 -42.15 63.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.279 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.78 -48.88 79.89 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.99 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 46.9 t -62.38 -46.29 96.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -36.9 76.64 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.947 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.38 -35.83 81.7 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.089 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 40.4 t -76.77 -42.92 33.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 36.9 t -119.97 108.56 23.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.032 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.73 -25.38 12.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.586 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -78.89 85.35 4.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.834 0.35 . . . . 0.0 110.782 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -133.24 177.41 7.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.002 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.91 -57.6 2.09 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.501 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -135.88 140.35 44.05 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.219 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.5 ' HB3' ' HG ' ' A' ' 78' ' ' LEU . 9.1 pt-20 -141.28 132.36 26.26 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.873 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -154.24 168.23 27.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.968 0.413 . . . . 0.0 111.63 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 23.0 t -106.9 145.29 14.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.028 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 84.5 mt -124.65 134.28 67.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.594 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -122.2 17.96 10.72 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.723 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -155.3 145.5 21.8 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 111.022 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -61.05 -28.68 69.24 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.497 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -59.93 -46.77 88.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.612 0.244 . . . . 0.0 110.561 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -66.63 -41.83 87.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.456 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 12.3 mt -53.36 -35.44 60.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.586 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -42.83 126.56 3.8 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.567 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.77 -37.89 44.88 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.007 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -59.24 -46.4 88.58 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.803 0.335 . . . . 0.0 110.619 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -61.41 -50.45 72.81 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.906 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 64' ' ' PHE . 32.6 mm -56.93 -45.76 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -48.32 74.53 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.348 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -62.87 -42.43 99.75 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.857 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -58.0 -50.91 71.8 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.018 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.25 -37.74 88.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.687 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -36.37 75.8 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.666 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -56.53 -42.1 77.9 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.206 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -113.65 87.83 2.7 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 110.369 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.6 60.86 3.66 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.705 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 175.43 -136.55 3.42 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.819 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -103.29 36.77 2.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.781 0.324 . . . . 0.0 111.451 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 51.15 46.87 25.83 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.482 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -70.91 -36.12 72.57 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.905 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.42 147.73 39.71 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.034 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -149.99 -37.9 0.15 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.121 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.99 14.72 5.75 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.008 0.432 . . . . 0.0 111.347 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 12.6 p -135.57 60.93 1.67 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.559 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.302 -179.966 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.011 0.434 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.9 p -120.35 130.29 54.35 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.56 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -119.57 149.11 42.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.097 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 17.1 tt -132.5 131.0 60.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.84 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.07 105.59 13.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.878 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -60.27 -41.47 93.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -62.42 -43.6 98.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.468 ' HB3' HG22 ' A' ' 37' ' ' VAL . . . -64.88 -57.34 9.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.091 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 t -54.33 -43.58 71.34 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.871 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.95 -45.18 94.81 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.713 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.68 -50.36 68.42 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 -50.78 72.68 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.627 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -55.94 -43.14 77.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.037 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.451 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 68.0 m-20 -64.55 -33.79 76.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.793 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.63 -46.81 62.63 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.701 0.286 . . . . 0.0 111.15 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 t -68.34 -38.69 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.449 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 9.6 ptm180 -67.52 -23.9 65.5 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -74.71 68.26 1.67 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.939 0.399 . . . . 0.0 111.291 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.51 19.67 1.79 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.697 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 52.82 67.13 2.26 Favored Glycine 0 C--N 1.339 0.725 0 C-N-CA 121.081 -0.581 . . . . 0.0 112.56 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 t -64.7 85.03 0.04 OUTLIER 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.717 0.294 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 57.81 27.3 14.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.716 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 67.7 t -143.22 117.8 4.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.845 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -108.11 -29.4 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.444 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 42.5 p-90 -129.78 159.62 35.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.966 0.412 . . . . 0.0 111.301 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.479 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -144.89 150.51 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.908 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.474 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 0.2 OUTLIER -91.06 162.57 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.027 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -148.18 101.6 3.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 pttt -132.23 159.71 38.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 35' ' ' THR . 54.3 p90 -116.01 131.79 56.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.74 103.04 14.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.849 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.84 -73.27 2.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.758 . . . . 0.0 111.734 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -155.45 32.81 0.37 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.724 0.297 . . . . 0.0 111.464 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.428 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 0.7 OUTLIER -140.5 117.56 11.19 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 11.2 mt -77.35 133.45 30.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.245 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.468 HG22 ' HB3' ' A' ' 9' ' ' ALA . 11.3 p -151.2 137.72 11.48 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.33 158.12 23.77 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.567 2.178 . . . . 0.0 112.639 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.474 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -127.12 -152.17 7.92 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.629 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 10.0 mp0 -35.48 140.81 0.09 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.536 0.734 . . . . 0.0 112.515 -179.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -139.03 98.2 3.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.56 167.56 24.74 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.26 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.449 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -85.41 -20.14 30.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.696 -0.252 . . . . 0.0 110.972 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -93.05 107.58 19.34 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.457 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.94 -21.17 65.11 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -46.34 -39.7 10.67 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.776 0.322 . . . . 0.0 110.631 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -42.55 94.94 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.409 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.407 ' O ' ' HB2' ' A' ' 52' ' ' CYS . 40.0 t80 -68.12 -42.41 80.25 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.878 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.01 -35.13 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.207 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.36 -37.25 25.91 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.694 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.98 -42.55 57.37 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -72.66 84.17 1.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.111 0.481 . . . . 0.0 111.049 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.05 164.48 22.44 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.563 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.4 38.5 0.83 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.777 0.323 . . . . 0.0 111.793 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.715 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -139.47 45.28 1.95 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.922 0.391 . . . . 0.0 111.336 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.423 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.48 157.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.812 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.31 134.91 45.91 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.325 179.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.9 mt -147.22 170.42 17.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.063 0.459 . . . . 0.0 111.965 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -119.68 160.5 22.41 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.118 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.81 153.44 29.79 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.897 0.379 . . . . 0.0 111.63 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -139.38 122.62 16.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.578 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.5 t -130.53 142.38 43.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.91 0.386 . . . . 0.0 111.628 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -101.92 118.47 36.99 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.717 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.444 ' HB2' HD22 ' A' ' 129' ' ' LEU . 58.2 m-85 -102.15 165.1 11.33 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.98 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.9 m -148.0 112.11 5.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.603 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 45.4 p -99.59 117.07 33.16 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.2 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.496 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.16 157.58 28.91 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.614 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.95 79.12 1.46 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.805 0.336 . . . . 0.0 111.211 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 31.39 49.85 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.8 ptm -177.31 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.637 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.9 p -148.23 91.11 1.87 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.913 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.496 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -112.29 122.36 47.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.716 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.69 135.86 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.985 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 149.78 30.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.256 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -144.18 162.71 35.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.602 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.449 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 8.2 m-85 -106.35 153.85 21.62 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.795 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -154.65 125.94 7.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.633 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.3 tt -92.66 127.33 38.12 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.345 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.5 mt -122.02 107.94 20.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.603 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.2 m -97.33 132.01 43.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.007 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.416 ' CZ3' HD13 ' A' ' 120' ' ' LEU . 75.3 t-105 -114.13 141.84 46.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.871 0.367 . . . . 0.0 111.304 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.6 mt -137.27 104.11 3.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.42 124.12 6.37 Favored Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.372 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.412 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.3 mp0 -27.61 -51.38 0.07 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.715 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 12.9 m-80 -71.41 49.07 0.15 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -178.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.412 ' H ' ' C ' ' A' ' 84' ' ' GLU . 7.1 p -112.39 115.4 49.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.389 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.62 160.06 28.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.051 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.83 -44.45 61.09 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.708 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.25 -45.29 88.08 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.79 0.328 . . . . 0.0 110.795 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.45 -44.1 79.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.686 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -59.09 -46.22 88.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.637 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.04 88.37 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.937 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.83 -44.09 81.71 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.764 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 98' ' ' LYS . 9.5 m -50.18 -40.05 45.73 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.662 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.83 -46.85 80.16 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.793 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.97 -44.93 79.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.065 0.433 . . . . 0.0 111.114 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -62.33 -36.25 81.59 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.875 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -58.06 -34.48 70.16 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.9 m -71.0 -43.29 68.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.705 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 83.4 mt -59.57 -50.75 72.69 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.128 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 104' ' ' VAL . 22.0 t -66.14 -31.66 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.954 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.9 -32.61 72.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.105 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -48.67 62.97 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 101' ' ' VAL . 6.7 m -71.19 -28.67 33.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 56.1 t -101.22 102.05 12.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -99.48 -32.03 11.33 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.456 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -85.9 86.12 7.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.818 0.342 . . . . 0.0 111.343 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.449 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 p90 -140.25 158.01 44.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.702 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.83 -59.6 1.67 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.492 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 151.57 47.49 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.283 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -139.69 135.83 33.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.998 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -160.14 165.62 31.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.03 0.443 . . . . 0.0 111.271 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 20.2 t -111.24 139.03 37.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.521 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 49.2 mt -124.3 142.41 41.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.324 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.9 p -135.12 26.5 3.54 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.362 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -138.09 138.05 38.34 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.417 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -60.5 -35.15 75.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.684 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.66 -46.9 71.08 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.521 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 1.7 mp0 -69.39 -28.95 66.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.843 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.416 HD13 ' CZ3' ' A' ' 81' ' ' TRP . 0.4 OUTLIER -67.01 -30.61 70.76 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.728 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -52.17 132.12 33.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -52.44 -35.07 51.34 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.991 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -61.67 -38.93 89.59 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.868 0.366 . . . . 0.0 110.607 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.521 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 7.9 t80 -68.82 -51.58 39.22 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 5.1 mt -54.68 -40.67 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.964 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -51.26 -41.9 60.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.006 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.7 t -70.88 -42.52 69.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -56.02 -34.65 66.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.711 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.444 HD22 ' HB2' ' A' ' 64' ' ' PHE . 0.3 OUTLIER -64.99 -50.27 66.99 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.556 0.217 . . . . 0.0 111.408 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -71.85 -40.97 68.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.283 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.455 ' HA ' ' HB3' ' A' ' 135' ' ' ALA . 5.4 mttt -70.98 -38.19 72.72 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.432 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 57.47 49.8 12.27 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 107.49 -64.71 0.26 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.808 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.42 103.42 0.2 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.33 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 131' ' ' LYS . . . -93.18 19.75 7.69 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.576 0.227 . . . . 0.0 111.465 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 48.58 35.77 6.58 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.376 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.15 62.29 4.76 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.279 0.561 . . . . 0.0 110.721 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -79.46 167.59 20.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.379 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -110.09 -37.85 5.46 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.707 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.74 14.92 15.76 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.71 39.94 29.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.843 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.501 -0.761 . . . . 0.0 111.164 -179.955 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.808 0.337 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 m -113.36 91.38 3.63 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.806 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -106.81 164.74 11.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.156 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.43 ' HB ' HD12 ' A' ' 36' ' ' ILE . 5.2 tt -115.26 130.38 69.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.021 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.62 101.98 8.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.472 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.36 -41.07 92.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.909 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -59.67 -51.63 68.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.948 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.12 -52.83 63.22 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.951 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.46 -39.39 73.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.153 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -44.94 96.32 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.99 67.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.25 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.41 -48.21 73.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.264 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.18 -46.97 79.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.886 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -55.89 -40.84 73.58 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.9 tp -65.46 -44.52 86.92 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.972 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.6 t -65.89 -35.01 74.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.779 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -61.17 -33.54 73.6 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.402 ' HB3' ' HB2' ' A' ' 22' ' ' SER . 3.5 t70 -54.87 131.21 43.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.034 0.445 . . . . 0.0 111.054 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.74 -38.68 67.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.593 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -155.25 87.55 0.13 Allowed Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.809 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.402 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 3.2 t -118.67 30.14 7.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.769 0.319 . . . . 0.0 111.401 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 58.15 26.92 14.32 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.2 t -144.99 125.37 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-O 120.732 0.301 . . . . 0.0 110.906 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.3 pp -112.46 -28.57 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.749 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -131.24 155.61 46.81 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 34.7 m -140.85 149.51 20.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.005 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.63 175.89 6.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.85 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -151.13 93.59 1.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.404 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -102.87 176.0 5.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -89.67 144.11 26.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.111 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.505 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.5 OUTLIER -122.77 79.09 1.6 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.888 178.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -72.58 2.13 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.468 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.4 m -150.13 31.89 0.68 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.806 0.336 . . . . 0.0 110.766 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.0 p -146.39 176.97 9.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.033 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' A' ' 5' ' ' ILE . 10.9 mt -106.85 131.39 56.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.182 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.505 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 23.2 m -145.73 138.45 13.89 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.926 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.21 168.22 3.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.468 2.112 . . . . 0.0 112.804 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.73 -153.78 7.15 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.993 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.425 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.4 mp0 -35.47 141.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.286 0.634 . . . . 0.0 112.428 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -136.84 98.12 3.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.356 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.42 168.62 25.76 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.839 -0.695 . . . . 0.0 113.209 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -87.88 -19.35 27.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.634 0.254 . . . . 0.0 110.86 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -89.97 111.27 22.29 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.7 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -68.0 -24.53 65.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.603 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.63 -36.09 15.07 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.016 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.25 -35.31 79.92 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.264 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -68.03 -40.6 82.86 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.561 0.22 . . . . 0.0 111.04 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 18.1 mt -64.31 -44.69 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.167 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -64.64 -40.8 96.09 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.768 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.39 -29.2 59.75 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.5 83.94 3.9 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.962 0.41 . . . . 0.0 111.35 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.61 173.59 8.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.577 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.2 2.8 17.03 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.658 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -126.41 77.37 1.69 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.751 0.31 . . . . 0.0 110.586 -179.659 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -170.11 -175.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.372 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.39 74.36 0.09 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.2 pp -129.39 168.12 16.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.338 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -96.38 170.54 9.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.87 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.0 145.21 34.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.972 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.406 ' HB3' ' CG2' ' A' ' 27' ' ' VAL . 1.1 t80 -132.77 128.55 37.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -150.38 134.31 8.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.841 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 ttp-105 -103.91 132.38 50.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -104.3 161.65 13.88 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.919 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -146.16 110.26 4.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.724 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 t -108.56 135.92 49.03 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.347 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.18 136.09 5.06 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.922 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -80.21 -178.47 6.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.35 8.55 0.31 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.451 ' H ' ' C ' ' A' ' 68' ' ' ASP . 14.1 ptm -157.64 21.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.75 166.5 33.23 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.771 0.319 . . . . 0.0 111.266 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.9 127.55 7.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.187 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.14 155.66 46.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.988 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.1 t -126.92 136.6 52.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.443 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mtmt -137.56 144.31 41.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.435 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.446 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 6.4 m-85 -90.03 153.54 20.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.034 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.31 114.88 9.41 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.243 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.33 93.22 4.86 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.638 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 5.4 mt -96.53 155.61 3.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.1 m -133.72 132.0 40.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.668 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.502 ' CE3' HD23 ' A' ' 120' ' ' LEU . 55.1 t-105 -108.71 129.38 55.36 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.853 0.359 . . . . 0.0 110.97 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.422 HG13 HG21 ' A' ' 86' ' ' VAL . 2.9 tt -125.73 100.87 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.718 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -75.37 113.91 4.1 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.086 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.433 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.6 mm-40 -24.56 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.658 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.3 m-80 -71.26 44.27 0.09 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.105 0.479 . . . . 0.0 111.67 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.433 ' H ' ' C ' ' A' ' 84' ' ' GLU . 9.0 t -77.47 142.58 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.471 179.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 162.05 29.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.029 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.17 -61.92 6.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.975 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -34.55 76.2 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.491 0.186 . . . . 0.0 111.217 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -33.36 68.74 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.29 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -52.91 -38.38 61.73 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.983 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.3 -37.09 23.9 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.101 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -57.59 -43.32 84.55 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.298 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.6 p -59.26 -37.6 78.02 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.267 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.92 -50.43 60.95 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.613 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.9 t -67.64 -31.54 71.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.624 0.249 . . . . 0.0 111.018 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.414 ' HA ' HD11 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.73 -39.17 83.79 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.243 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -57.0 -33.42 67.12 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.786 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.9 m -72.48 -44.33 62.45 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.414 HD11 ' HA ' ' A' ' 97' ' ' ASP . 17.5 mt -59.56 -45.31 92.22 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.991 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 46.1 t -65.78 -40.04 86.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 -36.6 80.68 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -45.76 78.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.739 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 29.6 t -71.87 -45.65 63.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.04 101.57 12.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.869 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -107.57 -32.24 7.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.443 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -81.44 71.82 8.45 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.903 0.382 . . . . 0.0 110.669 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.446 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 19.9 p90 -124.16 162.26 23.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.068 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.29 -46.52 5.78 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.66 132.0 15.58 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.067 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -133.43 127.87 34.3 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -160.35 162.45 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.981 0.42 . . . . 0.0 111.604 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.2 p -109.07 143.02 20.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.534 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.469 HD12 HD13 ' A' ' 120' ' ' LEU . 4.4 mt -128.13 136.99 58.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.9 m -100.96 -31.52 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.063 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -88.6 139.09 30.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.947 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 mmm-85 -70.5 -36.45 73.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.167 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -47.86 77.57 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.674 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -70.07 -23.85 63.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.008 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.502 HD23 ' CE3' ' A' ' 81' ' ' TRP . 6.7 tp -81.61 -21.64 38.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.8 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -47.88 138.78 8.41 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.094 0.473 . . . . 0.0 111.567 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -35.44 21.52 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.049 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -38.84 75.59 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.983 0.42 . . . . 0.0 110.175 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -77.85 -42.04 34.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 49.8 mt -58.75 -50.09 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.029 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -54.8 -39.32 68.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.2 t -72.4 -44.37 62.57 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -58.12 -48.1 81.26 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.976 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.02 -31.5 71.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.101 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -49.44 71.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.957 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -70.1 -52.24 25.32 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.882 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 59.01 32.55 22.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.462 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 86.78 -49.53 4.04 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.798 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 117.71 107.4 2.4 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.134 -0.555 . . . . 0.0 111.834 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -168.76 25.11 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.69 0.281 . . . . 0.0 111.695 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -150.48 21.14 0.83 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.862 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.15 -56.06 4.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.616 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -81.61 150.37 28.16 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.231 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.07 -56.51 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.194 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -131.97 17.51 4.63 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.66 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 6.3 m 60.22 62.33 1.62 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.464 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.118 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.94 0.4 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.07 130.12 40.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.677 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -135.69 -179.9 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.006 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 tt -146.29 133.13 14.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.886 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.489 ' HB3' HG13 ' A' ' 37' ' ' VAL . 6.8 t70 -77.27 112.74 14.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.744 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.44 -45.28 76.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.058 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.81 -50.17 74.84 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.0 -57.0 14.74 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.305 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.2 m -58.49 -46.66 86.24 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.407 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -60.42 -49.66 76.68 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.42 -47.65 69.41 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.903 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.81 -35.03 72.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.452 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -66.09 -62.1 1.67 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.31 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -64.08 -32.8 74.5 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.919 0.341 . . . . 0.0 111.919 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.5 tt -61.55 -49.66 75.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.749 0.309 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.7 t -75.4 -32.03 24.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -4.35 41.5 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.896 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -70.96 80.8 0.65 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.813 0.34 . . . . 0.0 111.14 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 52.92 25.37 3.92 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.386 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 68.25 72.53 0.8 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.092 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 26.4 p -66.55 -169.98 0.09 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.524 0.202 . . . . 0.0 110.932 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.85 52.88 1.29 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 111.15 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 41' ' ' GLN . 49.4 t -152.92 101.77 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.281 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -85.81 -27.35 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.644 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 21.9 p-90 -138.46 153.85 48.84 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.344 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 3.4 t -139.45 152.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.992 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.583 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 1.7 m -92.15 165.85 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.757 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -149.69 99.45 2.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.225 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 153.09 52.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.855 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 36' ' ' ILE . 55.1 p90 -96.07 128.77 43.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.414 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.19 109.02 21.85 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.842 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.62 -50.66 3.87 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.195 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.6 p -171.14 -33.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -83.5 132.62 34.93 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.876 0.37 . . . . 0.0 111.41 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' TYR . 50.7 mt -79.5 136.07 24.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.954 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.489 HG13 ' HB3' ' A' ' 6' ' ' ASP . 15.6 m -151.03 155.94 35.19 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.86 164.72 30.51 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.318 2.012 . . . . 0.0 112.09 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.583 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -134.38 -150.76 6.23 Favored Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.554 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.6 mp0 -31.59 136.13 0.06 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.461 0.705 . . . . 0.0 112.579 -179.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.418 ' HB3' HG13 ' A' ' 24' ' ' VAL . 8.2 mt-30 -130.69 91.37 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.228 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.66 164.18 25.18 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.26 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.446 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -88.35 -23.46 23.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.686 0.279 . . . . 0.0 110.718 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.96 115.51 22.85 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.688 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -67.22 -22.46 65.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.93 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -48.07 -37.2 14.59 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.663 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -38.67 91.87 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.298 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -67.91 -41.73 82.23 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.633 0.254 . . . . 0.0 111.013 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.8 mt -63.51 -42.49 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.64 -40.5 73.05 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.642 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -34.29 68.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.623 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.5 m -76.44 82.98 3.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.961 0.41 . . . . 0.0 111.431 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.49 162.18 24.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -84.83 13.27 6.04 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.638 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -129.2 52.71 1.94 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 110.721 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.422 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 171.69 148.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.847 -179.492 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.3 129.13 56.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.73 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.43 174.47 10.6 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -115.79 167.2 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.264 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.82 154.01 35.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 111.415 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -136.21 110.07 8.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.12 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 t -115.29 122.68 69.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.723 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.41 107.72 18.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.84 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -103.59 159.17 15.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.052 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 6.8 t -148.51 127.17 12.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.1 p -113.99 88.71 2.91 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.061 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.36 175.25 37.13 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.553 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -159.91 79.16 0.69 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 111.072 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.55 31.11 1.25 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.55 -34.84 0.18 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.527 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -158.42 80.14 0.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.995 0.426 . . . . 0.0 110.551 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -79.67 98.61 7.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.802 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.404 ' O ' ' HA ' ' A' ' 65' ' ' THR . 4.8 tpp180 -100.41 110.97 23.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.798 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.5 140.58 29.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.019 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.6 mttm -130.87 121.99 26.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.961 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -96.08 117.6 31.03 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.426 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.07 138.39 52.91 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.488 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.5 tp -117.7 100.18 7.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.0 mt -85.95 113.66 24.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.077 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.409 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 4.5 m -99.53 108.69 21.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.528 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -98.52 141.12 31.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.885 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.444 HD11 HG23 ' A' ' 82' ' ' ILE . 46.2 mt -139.9 94.1 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.261 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.84 109.77 2.9 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.518 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.459 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.3 mm-40 -33.78 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.638 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.6 m-80 -73.13 41.81 0.11 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.273 0.558 . . . . 0.0 111.575 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.459 ' H ' ' C ' ' A' ' 84' ' ' GLU . 2.5 m -99.26 137.33 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.348 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 m -66.28 165.55 13.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.772 0.32 . . . . 0.0 111.23 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.08 -36.47 67.89 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.98 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.81 -36.12 82.86 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.553 0.216 . . . . 0.0 111.083 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -36.77 84.55 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.042 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.94 -45.27 78.84 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.782 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -35.71 74.19 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.197 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.11 -41.82 68.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.475 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -58.04 -39.26 77.99 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.136 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.23 -49.21 67.64 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.379 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -42.94 88.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.586 0.231 . . . . 0.0 110.964 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.39 -36.11 77.34 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.179 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -34.53 65.75 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.907 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 59.1 m -76.45 -47.79 21.85 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.903 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.87 -47.85 84.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.178 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 45.5 t -64.59 -40.12 87.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.764 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -57.61 -44.96 85.86 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.856 179.376 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -59.7 -41.88 91.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.8 t -72.28 -37.8 59.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.409 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.6 t -125.52 104.15 12.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 120.873 0.368 . . . . 0.0 110.823 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 2.9 mt-30 -109.23 -40.38 4.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.095 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -86.62 85.5 7.3 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.059 0.457 . . . . 0.0 111.109 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -133.61 160.41 37.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.982 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.65 -51.18 29.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.03 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.8 161.7 3.87 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -148.08 150.04 33.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.051 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -157.41 160.79 38.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.152 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.409 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 10.2 p -102.32 142.59 16.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.99 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 3.9 mt -134.68 141.85 42.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.063 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 t -135.15 31.26 3.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.848 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -145.12 136.55 25.18 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.705 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -59.0 -36.56 75.12 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.68 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -69.17 -44.7 71.69 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.556 0.217 . . . . 0.0 110.84 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -73.35 -31.22 63.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.159 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.5 tp -74.0 -28.55 61.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.09 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -45.45 133.18 7.63 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.448 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -51.14 -32.15 22.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.1 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -56.71 -41.38 77.31 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.976 0.417 . . . . 0.0 110.29 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -70.43 -46.01 64.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.903 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 20.1 mm -61.14 -46.12 97.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.228 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -60.53 -37.87 82.58 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.619 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.62 -42.26 74.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.657 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.16 -43.13 99.36 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.093 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -43.4 89.13 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.237 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -64.31 -32.29 73.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.16 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.57 -49.36 36.92 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.239 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -110.14 43.27 1.39 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.983 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -139.01 -50.83 0.05 OUTLIER Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.717 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -92.2 -163.61 37.99 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.599 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -117.96 33.82 5.45 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.673 0.273 . . . . 0.0 111.282 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 50.6 47.65 23.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.042 0.449 . . . . 0.0 110.985 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -68.94 -26.97 65.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.562 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.488 ' HB3' HG23 ' A' ' 141' ' ' THR . 6.0 t0 -59.03 154.52 15.42 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.067 0.461 . . . . 0.0 110.934 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -113.68 -20.34 11.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.546 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -91.17 13.62 16.52 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' THR . . . . . 0.488 HG23 ' HB3' ' A' ' 138' ' ' ASP . 11.1 t -158.45 46.09 0.32 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.087 0.47 . . . . 0.0 110.932 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.91 179.824 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.649 0.262 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 m -121.25 144.38 48.64 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.743 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -134.48 167.37 20.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.025 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -123.29 122.82 66.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.426 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -75.31 107.18 7.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -36.88 74.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.777 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -66.75 -46.64 74.75 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.91 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.77 -51.63 61.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.302 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.2 t -55.48 -44.8 76.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -44.01 87.15 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.77 -49.61 47.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.131 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.56 -36.87 73.88 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.651 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -55.35 -55.1 35.42 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.54 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.434 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 21.6 p30 -75.23 -20.97 58.95 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.3 -44.18 46.94 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.612 0.244 . . . . 0.0 111.318 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.501 HG21 HG13 ' A' ' 27' ' ' VAL . 19.4 t -72.5 -40.16 62.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.513 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -59.16 -25.75 64.17 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.49 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.31 125.58 27.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.807 0.337 . . . . 0.0 110.797 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -90.42 35.49 0.87 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.256 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.45 -32.44 2.14 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.941 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.26 157.98 16.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.05 0.425 . . . . 0.0 111.33 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.88 59.34 3.13 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.65 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.2 t -129.0 108.42 17.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.033 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.424 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.2 pt -106.32 -29.89 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.513 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 31.0 p-90 -135.16 155.99 49.76 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.928 0.394 . . . . 0.0 111.179 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.501 HG13 HG21 ' A' ' 17' ' ' VAL . 16.7 m -141.38 149.05 20.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.225 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.502 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 0.6 OUTLIER -92.68 175.94 6.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.59 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 5.6 m-85 -144.82 104.73 4.04 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.007 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.98 -179.2 4.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.401 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -84.09 163.74 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.52 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.459 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -147.36 84.63 1.57 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.817 179.333 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 75.15 -68.64 2.0 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.303 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -156.68 34.88 0.31 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.8 t -158.39 158.46 34.28 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.414 HG12 ' OD2' ' A' ' 97' ' ' ASP . 3.6 mt -84.93 134.6 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.12 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.459 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 30.7 m -147.54 157.36 44.85 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.009 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.448 ' HD2' ' HB ' ' A' ' 37' ' ' VAL . 37.9 Cg_endo -65.88 171.37 9.99 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.335 2.023 . . . . 0.0 112.146 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.502 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -135.91 -151.91 6.25 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.53 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.513 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.35 140.27 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.418 0.687 . . . . 0.0 112.248 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.412 ' CG ' HG11 ' A' ' 27' ' ' VAL . 10.0 mt-30 -135.33 100.94 4.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.184 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.52 161.5 24.48 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.128 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.56 -26.75 34.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 0.0 110.52 179.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -96.04 122.42 38.85 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.533 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -68.2 -18.09 64.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.905 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -47.58 -40.12 18.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.623 0.249 . . . . 0.0 110.973 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.19 -39.66 91.03 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.226 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -66.43 -47.6 72.67 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.893 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.9 mt -58.18 -38.5 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.714 0.292 . . . . 0.0 110.781 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.41 -36.38 83.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.574 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.06 -23.44 22.55 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -73.46 81.97 1.45 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.212 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.2 p -109.48 146.13 35.09 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.638 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.543 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.7 m-20 -80.07 70.14 6.61 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.01 0.433 . . . . 0.0 111.385 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.694 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.9 t70 -165.5 45.08 0.08 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.204 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' A' ' 57' ' ' ARG . 2.9 p 178.29 -147.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.535 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -163.71 123.41 2.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.392 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.1 pp -158.85 156.8 30.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.878 0.371 . . . . 0.0 111.322 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.533 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 67.3 m-85 -99.69 172.21 7.41 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.554 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.22 156.22 41.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.415 ' CE2' HD13 ' A' ' 78' ' ' LEU . 1.2 t80 -147.24 122.11 9.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.68 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.8 t -130.98 143.05 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-O 120.888 0.375 . . . . 0.0 111.507 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD2' ' CG1' ' A' ' 17' ' ' VAL . 60.7 mtt85 -121.71 112.67 18.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.551 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -95.45 165.52 12.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.269 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 20.2 m -138.54 120.28 15.25 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.777 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 p -112.13 91.42 3.65 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.83 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.415 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -159.34 172.39 35.99 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.451 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -159.25 79.27 0.75 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 0.0 111.28 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.36 30.74 0.74 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.408 ' HG3' ' N ' ' A' ' 71' ' ' SER . 4.1 ptm -149.82 -34.23 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 70' ' ' MET . 28.9 p -158.87 81.77 0.79 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.708 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.415 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 18.1 tttm -79.63 101.09 8.15 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.368 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 65' ' ' THR . 8.6 mmt180 -102.34 149.39 24.39 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.028 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.36 147.74 32.23 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -130.25 162.04 29.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.932 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -130.37 146.92 52.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.617 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -146.76 111.51 5.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.494 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 14.8 tp -103.48 86.74 2.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.895 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 mp -96.26 141.4 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.249 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.7 m -114.35 124.18 51.34 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.431 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.7 t-105 -94.18 133.55 37.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.834 0.349 . . . . 0.0 110.745 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.0 tt -128.33 90.82 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.837 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.543 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.56 111.33 4.06 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.709 -0.757 . . . . 0.0 111.692 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.418 ' C ' ' H ' ' A' ' 86' ' ' VAL . 6.0 mm-40 -37.07 -45.84 0.63 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -178.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.694 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.1 m-80 -73.68 46.54 0.22 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.418 ' H ' ' C ' ' A' ' 84' ' ' GLU . 12.4 p -104.89 134.59 45.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.25 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 p -63.17 153.87 33.02 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.938 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.36 58.58 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 113.2 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -43.25 92.22 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.797 0.299 . . . . 0.0 111.073 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -67.68 -33.78 75.61 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.997 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -34.63 69.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.951 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.56 -33.93 27.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.949 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.5 tptt -56.13 -44.07 78.82 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.477 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.6 t -61.35 -34.16 74.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.727 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.54 -48.88 82.16 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.06 -0.59 . . . . 0.0 112.103 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -38.44 86.35 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.568 0.223 . . . . 0.0 110.718 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.414 ' OD2' HG12 ' A' ' 36' ' ' ILE . 4.5 m-20 -60.98 -44.88 96.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.099 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.4 ttpt -58.79 -29.9 67.18 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.8 m -71.99 -45.37 61.23 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.448 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.2 mt -62.33 -47.65 83.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.098 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.418 ' O ' HG11 ' A' ' 104' ' ' VAL . 12.5 p -66.2 -32.77 59.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -68.46 -38.18 80.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.763 0.316 . . . . 0.0 110.837 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -47.22 68.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.418 HG11 ' O ' ' A' ' 101' ' ' VAL . 14.8 p -71.04 -33.13 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.642 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -109.17 91.87 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.939 0.399 . . . . 0.0 110.714 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -98.83 -35.96 9.95 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.046 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -79.43 79.78 5.86 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 110.829 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -127.84 -179.78 5.13 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -114.11 -50.98 2.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.344 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -145.16 150.96 37.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 7.7 pt-20 -151.99 128.39 10.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 16.4 p90 -159.78 159.43 32.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.341 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.73 146.1 7.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.727 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 58.7 mt -132.85 144.71 35.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.11 31.26 2.43 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.078 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -147.07 140.54 25.54 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.916 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.421 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -60.9 -34.96 75.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.462 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.1 tttm -75.3 -37.85 60.62 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.73 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -67.2 -45.09 77.91 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.825 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.421 ' CD2' ' HA ' ' A' ' 117' ' ' ARG . 4.5 pp -72.02 -22.15 61.45 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.343 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -48.27 133.57 15.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.769 0.319 . . . . 0.0 110.874 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -49.15 -34.09 13.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.058 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -60.09 -46.29 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.894 0.378 . . . . 0.0 110.285 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -68.51 -44.23 75.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.107 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 37.5 mm -59.85 -45.24 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.13 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -57.34 -39.85 76.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.105 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.7 t -71.52 -46.19 60.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.727 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -57.08 -39.84 75.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mp -72.51 -37.75 68.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.522 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -68.84 -56.27 8.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.5 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -75.23 -58.68 3.13 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.101 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 53.14 40.49 31.31 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.843 0.354 . . . . 0.0 111.517 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -94.54 -39.78 4.62 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.638 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.77 20.86 70.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 121.255 -0.498 . . . . 0.0 113.466 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -173.24 24.01 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -148.91 21.6 0.99 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.959 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -89.53 -49.37 6.72 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.694 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.66 159.56 37.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.069 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -115.31 -35.6 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.552 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.96 18.14 12.53 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 111.66 0.244 . . . . 0.0 111.66 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 14.4 t 44.11 47.4 7.46 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.797 0.439 . . . . 0.0 111.796 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.874 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 120.578 0.228 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.87 102.32 10.84 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.601 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -104.86 162.28 13.46 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.09 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -118.73 135.45 59.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.07 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.468 ' HB2' HG13 ' A' ' 37' ' ' VAL . 1.4 m-20 -85.32 115.02 22.83 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.4 -41.64 93.44 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.078 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.32 -44.78 78.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.147 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.24 -59.57 5.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.238 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.8 m -55.73 -43.68 76.82 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.384 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -65.02 -41.66 95.08 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.467 ' HA ' ' ND2' ' A' ' 15' ' ' ASN . . . -55.18 -55.53 30.21 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.845 0.355 . . . . 0.0 110.733 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.59 -38.49 81.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.412 ' O ' HG21 ' A' ' 17' ' ' VAL . 1.0 OUTLIER -57.68 -50.53 72.88 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.467 ' ND2' ' HA ' ' A' ' 12' ' ' ALA . 13.0 p30 -62.13 -29.49 70.37 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.84 -45.36 15.65 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.691 0.281 . . . . 0.0 111.34 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.412 HG21 ' O ' ' A' ' 14' ' ' TYR . 27.1 m -64.82 -29.75 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.698 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -56.62 -40.07 74.73 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.177 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.68 124.12 20.62 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.604 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.72 39.48 1.21 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.223 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -165.74 37.34 0.27 Allowed Glycine 0 C--N 1.335 0.506 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.836 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -123.49 26.02 8.01 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.907 0.354 . . . . 0.0 111.483 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 60.1 28.01 17.52 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.713 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.3 t -139.13 114.54 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.74 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.44 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.3 pt -110.97 -27.56 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.42 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 40.8 p-90 -128.19 161.82 28.41 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.883 0.373 . . . . 0.0 111.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -144.07 151.87 16.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.521 179.178 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.429 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 64.0 m -93.21 161.08 14.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.692 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -146.12 99.24 3.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.997 0.427 . . . . 0.0 110.274 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.23 -179.57 5.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.703 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.49 ' HB3' HD13 ' A' ' 36' ' ' ILE . 52.2 p90 -131.54 132.94 44.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.204 0.526 . . . . 0.0 111.547 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -104.03 114.0 27.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.238 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.67 -74.35 1.78 Allowed Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.998 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 m -162.09 33.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.542 0.21 . . . . 0.0 111.515 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.4 p -140.7 134.58 30.55 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.851 0.357 . . . . 0.0 111.039 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.49 HD13 ' HB3' ' A' ' 31' ' ' TYR . 39.9 mm -81.69 130.9 35.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.814 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.468 HG13 ' HB2' ' A' ' 6' ' ' ASP . 16.7 m -152.62 142.59 15.01 Favored Pre-proline 0 C--O 1.233 0.212 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.213 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -60.24 165.7 10.4 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.504 2.136 . . . . 0.0 112.276 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.429 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -134.95 -149.05 5.8 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.449 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.1 mp0 -34.88 136.48 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.388 0.675 . . . . 0.0 112.514 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -137.32 98.87 3.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.281 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.68 165.85 27.09 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.415 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.44 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.32 -22.04 33.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.679 -0.26 . . . . 0.0 110.79 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -88.45 109.44 20.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.537 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -66.86 -21.12 66.02 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.4 -39.2 21.67 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.767 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.51 -36.97 84.25 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.3 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -70.11 -42.08 73.13 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.903 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 63.3 mt -60.51 -40.41 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.753 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -70.8 -36.15 72.86 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.438 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -34.34 58.59 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.695 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.29 82.96 1.38 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 111.656 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.16 155.9 25.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.77 11.27 6.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.709 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -128.25 53.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.833 0.349 . . . . 0.0 110.912 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.406 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.48 153.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.143 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.454 ' HD2' ' HB ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -111.18 143.1 42.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.738 179.289 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -160.55 177.22 10.74 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.785 0.326 . . . . 0.0 111.591 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -116.49 158.73 23.13 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.937 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.99 164.27 34.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.985 0.421 . . . . 0.0 111.614 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -150.81 121.48 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.242 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 39.7 t -124.96 134.34 67.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.601 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -93.08 113.8 26.15 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.217 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.4 143.22 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.373 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.6 t -152.3 104.27 2.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.497 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.28 94.45 5.05 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.859 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.18 146.78 13.12 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.83 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.27 79.84 1.24 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.768 0.318 . . . . 0.0 110.973 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 41.45 62.53 1.5 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.298 0.57 . . . . 0.0 112.092 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -179.08 -46.92 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.3 m -158.71 100.2 1.6 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.322 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.536 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 4.2 mttt -93.24 128.36 39.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.093 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -133.32 102.83 5.7 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.219 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.08 127.54 53.57 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.677 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -144.79 157.07 44.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.874 0.369 . . . . 0.0 111.366 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -110.78 137.81 47.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.591 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.74 128.54 37.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.27 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tt -89.78 132.19 35.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.443 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 14.8 mt -123.92 125.02 70.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.496 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.9 m -106.54 119.82 40.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.093 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 37.6 t-105 -98.52 137.4 37.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 111.498 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 53.3 mt -137.4 87.27 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.932 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -63.2 106.46 1.33 Allowed Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.785 -0.643 . . . . 0.0 113.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 1.02 -65.22 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.709 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 30.4 m-80 -45.94 -21.66 0.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.408 HG11 ' HB2' ' A' ' 90' ' ' GLN . 53.5 t -54.53 107.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.615 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 m -74.3 173.07 10.73 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.33 -43.15 57.37 Favored Glycine 0 C--N 1.336 0.567 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.061 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.58 -46.99 73.83 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.713 0.292 . . . . 0.0 110.808 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.408 ' HB2' HG11 ' A' ' 86' ' ' VAL . 9.3 mp0 -68.24 -37.67 81.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.358 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -58.03 -35.87 71.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 -38.91 71.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.93 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -59.72 -49.05 79.23 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.164 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.454 ' HB ' ' HD2' ' A' ' 57' ' ' ARG . 9.2 t -61.04 -33.38 73.21 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.23 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.72 93.65 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.963 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.18 -38.72 66.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.56 0.219 . . . . 0.0 110.498 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -58.19 -41.4 83.87 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.344 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -55.79 -33.68 64.6 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.745 0.307 . . . . 0.0 110.648 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.2 m -70.52 -44.43 67.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.426 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 61.9 mt -58.38 -49.35 77.56 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.674 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.1 t -64.98 -38.85 83.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.022 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 ttmt -60.95 -44.34 97.41 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.145 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -58.42 -45.34 88.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.69 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 t -74.89 -41.05 46.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 38.8 t -104.53 74.48 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 121.067 0.461 . . . . 0.0 110.754 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -77.62 -26.37 50.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.418 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.98 83.57 5.86 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.843 0.354 . . . . 0.0 110.73 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -132.42 158.43 42.02 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -110.51 -48.93 3.1 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.341 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.55 116.7 7.88 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.026 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -122.32 131.21 53.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.964 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -158.01 154.95 28.52 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.028 0.442 . . . . 0.0 111.51 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.3 m -89.68 156.28 3.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.357 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 57.8 mt -138.51 140.6 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.955 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -124.25 13.35 8.93 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.78 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -148.44 144.28 27.32 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.942 0.401 . . . . 0.0 110.871 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -60.27 -29.71 68.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.989 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -46.75 88.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.731 0.301 . . . . 0.0 110.855 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.414 ' HG2' ' CZ ' ' A' ' 124' ' ' PHE . 1.0 OUTLIER -74.26 -25.81 59.84 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.621 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.41 -22.77 32.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.675 0.274 . . . . 0.0 111.045 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.434 ' HG2' ' OD1' ' A' ' 123' ' ' ASN . 12.5 tt0 -54.48 133.13 45.81 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.76 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -49.15 -45.08 43.29 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.177 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.434 ' OD1' ' HG2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -58.48 -32.79 69.1 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.25 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.414 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 20.6 t80 -74.81 -51.01 15.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.824 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 21.6 mt -59.0 -48.18 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.071 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -55.0 -38.6 68.06 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.9 t -66.09 -49.11 68.69 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.04 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -60.26 -50.27 74.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.91 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.09 -37.19 84.12 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.4 tttp -69.5 -45.48 68.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.612 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp -74.45 -68.05 0.57 Allowed 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.057 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 55.38 51.84 12.31 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.87 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -121.13 33.51 4.34 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.096 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -127.56 88.96 0.33 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.296 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 75.88 19.6 1.9 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.884 0.373 . . . . 0.0 111.278 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -155.06 24.73 0.43 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.743 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -63.99 -27.82 69.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.59 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -64.85 157.36 28.05 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.971 0.415 . . . . 0.0 111.02 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -172.58 -64.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.94 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -143.5 16.92 1.85 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.872 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.5 m -95.66 -52.14 4.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.065 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.686 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.797 0.332 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.12 139.89 45.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -100.25 147.21 26.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.516 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.9 tt -124.68 131.05 73.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -89.08 108.11 19.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.565 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -67.9 -34.05 75.89 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.153 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -54.89 40.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.218 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.97 -46.28 71.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.339 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 m -58.32 -45.09 88.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.302 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -68.77 -45.08 72.31 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.52 -46.66 73.56 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.781 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.07 -47.62 83.84 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -56.2 -43.32 78.37 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.143 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -59.44 -46.17 89.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tt -65.31 -43.75 90.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.826 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.6 t -66.72 -31.18 52.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.729 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -37.71 70.57 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.699 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.95 125.62 26.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.703 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -99.34 25.59 6.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.049 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.16 -32.35 4.06 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.862 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -82.91 159.93 22.21 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.834 0.317 . . . . 0.0 111.112 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.85 -22.27 66.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.795 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.448 HG22 ' HG2' ' A' ' 41' ' ' GLN . 92.5 t -54.77 118.54 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.604 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 43' ' ' ALA . 31.7 pt -113.78 -36.29 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.718 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.483 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.3 p-90 -136.21 157.61 46.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.037 0.446 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.426 HG12 ' HG3' ' A' ' 41' ' ' GLN . 4.6 m -138.64 144.74 29.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.473 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.43 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 97.5 m -84.9 162.53 19.43 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.553 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.502 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 6.9 m-85 -144.75 96.41 2.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.127 0.489 . . . . 0.0 110.21 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -125.86 179.93 4.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.681 -179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -109.4 125.4 52.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.926 0.393 . . . . 0.0 111.301 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.84 101.04 12.83 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.02 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.12 -68.89 2.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.887 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.7 p -160.17 33.08 0.17 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.633 0.254 . . . . 0.0 111.231 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -149.91 131.06 14.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.6 mm -71.31 129.68 35.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.986 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.0 m -152.22 157.43 33.95 Favored Pre-proline 0 C--O 1.234 0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.111 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -62.46 162.59 23.57 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.653 2.236 . . . . 0.0 112.499 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.43 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -138.22 -146.93 5.11 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.706 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 1.9 mp0 -30.3 133.88 0.06 Allowed 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.499 0.719 . . . . 0.0 112.895 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.448 ' HG2' HG22 ' A' ' 24' ' ' VAL . 6.7 tt0 -131.42 101.14 5.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.001 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.03 165.32 25.16 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.503 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.449 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.37 -12.13 33.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.254 0.222 . . . . 0.0 111.464 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -116.08 134.04 55.37 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.668 0.271 . . . . 0.0 110.542 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -69.96 -19.16 63.37 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.894 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -49.81 -40.12 40.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.651 0.262 . . . . 0.0 110.84 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -36.16 79.22 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.403 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 52' ' ' CYS . 42.2 t80 -64.78 -61.12 2.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 121.289 -0.164 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 40.6 mt -57.59 -30.77 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.159 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -47.0 85.8 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.905 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -99.57 -0.16 41.03 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -88.45 88.83 7.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.036 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.1 156.86 17.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.921 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.1 p-10 -80.48 62.44 4.58 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.512 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.695 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 2.2 t0 -161.62 43.45 0.15 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.314 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.434 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.86 153.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.722 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.7 127.3 52.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.327 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 13.4 mt -142.58 156.38 45.09 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.924 0.392 . . . . 0.0 111.671 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.502 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 78.9 m-85 -104.29 161.22 14.23 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.186 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.405 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -154.15 146.47 23.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.879 0.371 . . . . 0.0 111.505 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -128.56 110.7 12.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.523 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.2 t -125.93 131.13 72.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.889 0.376 . . . . 0.0 111.361 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.9 mtm-85 -88.3 151.48 22.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.692 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -127.83 158.98 36.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.2 t -142.63 129.27 20.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.732 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.8 p -119.29 88.9 3.02 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.53 175.3 37.28 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.75 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.94 79.38 0.69 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.078 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 41.47 40.61 1.35 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.359 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 ptt? -157.94 -39.31 0.07 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.433 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.5 m -155.4 87.47 1.11 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.749 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 110.18 15.5 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.949 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.9 mtp180 -110.47 111.86 23.4 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.101 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.6 t -84.2 144.65 28.81 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -143.3 157.0 44.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -107.49 147.74 30.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.71 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -147.7 115.81 6.52 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.445 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.6 tt -94.21 106.48 18.45 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.179 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.0 mm -94.67 120.95 44.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.285 -179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.95 123.81 48.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.252 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -105.85 136.01 46.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.462 ' CG2' HG21 ' A' ' 86' ' ' VAL . 36.7 mt -137.6 93.36 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.468 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -64.38 112.28 4.86 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.573 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.447 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.6 mt-10 -24.72 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.695 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.3 m-80 -72.16 43.23 0.1 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.462 HG21 ' CG2' ' A' ' 82' ' ' ILE . 11.6 t -75.77 126.87 36.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.596 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.5 p -73.11 163.74 27.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.991 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.08 -38.77 39.96 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 121.215 -0.517 . . . . 0.0 113.084 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.6 mp -81.6 -40.52 22.88 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -37.32 74.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.458 -179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -41.39 89.11 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.628 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.27 -38.54 78.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.753 179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -52.87 -41.45 64.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.21 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 m -52.51 -46.78 66.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.376 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.7 -47.71 74.02 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.917 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -45.51 90.61 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.989 0.395 . . . . 0.0 111.008 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.425 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 78.6 m-20 -64.69 -39.21 93.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.318 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -57.27 -33.6 67.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.767 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.1 m -71.33 -48.7 48.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.557 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 52.6 mt -56.04 -51.69 66.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 44.1 t -60.81 -39.55 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.143 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -55.0 -41.92 71.86 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.999 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.84 -34.08 66.56 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.228 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.64 -47.08 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.531 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 26.4 t -106.89 114.98 47.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -107.24 -29.08 9.53 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.283 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -93.83 88.0 5.61 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.737 0.303 . . . . 0.0 111.03 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -141.61 168.75 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.38 -53.87 2.9 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.456 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -150.34 147.44 27.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.605 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -142.88 120.12 11.52 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.61 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -145.84 148.47 32.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.874 0.368 . . . . 0.0 111.262 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 6.1 m -81.31 160.59 3.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.474 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.533 HG23 ' N ' ' A' ' 120' ' ' LEU . 77.3 mt -141.09 132.86 28.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.103 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 m -116.61 -17.65 10.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.846 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.47 151.99 32.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.891 0.377 . . . . 0.0 111.176 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.479 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 32.1 ttp180 -64.2 -26.41 68.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.615 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 6.9 tptp -68.31 -38.06 81.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.993 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.453 ' HG2' ' CZ ' ' A' ' 124' ' ' PHE . 1.2 mt-10 -73.4 -39.31 65.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.646 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.533 ' N ' HG23 ' A' ' 114' ' ' ILE . 4.2 pp -74.77 -15.97 60.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.251 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -51.46 130.15 26.87 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.986 0.422 . . . . 0.0 110.697 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -48.05 -44.74 31.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.714 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -62.8 -41.31 99.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.939 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.453 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 32.9 t80 -59.47 -52.24 66.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.22 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 11.5 mt -55.21 -42.9 68.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.914 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -57.29 -40.99 78.92 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 32.6 t -69.27 -41.96 76.17 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.71 88.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.253 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mp -71.05 -33.03 69.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.53 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -76.09 -48.88 19.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.326 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -69.11 0.55 Allowed 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.826 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 43.07 56.41 4.12 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 57.73 60.23 9.37 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.288 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -65.96 -122.87 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.285 -0.483 . . . . 0.0 112.951 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 177.36 27.27 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -132.47 13.99 4.53 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.919 0.39 . . . . 0.0 111.269 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -69.87 -43.98 70.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.219 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -74.69 149.75 39.77 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.042 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -101.77 -32.9 10.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.33 15.48 9.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.884 0.373 . . . . 0.0 111.583 -179.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 15.4 t -131.47 37.26 3.7 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.157 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.733 0.301 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.92 129.12 42.08 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.068 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -136.52 145.04 44.62 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.531 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 13.9 tt -112.72 128.67 69.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -75.69 102.49 5.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.556 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -34.59 74.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.009 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -69.6 -50.12 47.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.898 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.442 ' CB ' HG13 ' A' ' 37' ' ' VAL . . . -62.46 -54.26 42.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.3 t -56.02 -37.09 68.71 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.813 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -60.04 -52.61 64.62 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.59 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.85 -48.77 66.82 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.126 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.27 -36.42 73.23 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.59 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.86 -62.08 2.12 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.267 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -62.55 -33.44 74.94 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -48.39 82.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.675 0.274 . . . . 0.0 110.819 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.0 t -72.58 -30.66 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.46 -36.71 64.4 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.987 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.38 124.67 26.94 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.58 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -97.04 29.02 3.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -115.73 15.39 16.88 Favored Glycine 0 C--N 1.335 0.525 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.798 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 t -132.31 162.21 31.59 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.874 0.369 . . . . 0.0 110.972 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.72 58.35 2.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.054 0.454 . . . . 0.0 110.579 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.3 t -141.48 104.46 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.0 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.1 pp -108.62 -26.37 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.563 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 26.8 p-90 -135.65 157.9 45.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.859 0.361 . . . . 0.0 111.333 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.487 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 27.0 m -140.99 150.06 20.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.268 179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.47 174.71 6.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.967 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -149.39 96.02 2.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.187 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.06 175.23 5.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.419 -179.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.433 ' CE2' ' HD3' ' A' ' 93' ' ' LYS . 0.8 OUTLIER -104.18 120.7 41.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.912 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -102.54 89.82 3.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.201 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.63 -79.62 1.38 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.146 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.25 32.06 1.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.786 0.327 . . . . 0.0 111.21 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.6 t -154.36 148.87 26.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.663 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.7 pt -90.04 135.36 26.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.952 0.406 . . . . 0.0 111.232 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.442 HG13 ' CB ' ' A' ' 9' ' ' ALA . 44.6 t -141.98 139.35 18.01 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.602 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.07 153.16 9.48 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.61 2.207 . . . . 0.0 112.248 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -126.17 -152.96 8.25 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.653 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.0 mp0 -34.05 139.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.562 0.745 . . . . 0.0 112.682 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -134.42 94.64 3.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.217 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.08 165.58 21.79 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.782 -0.723 . . . . 0.0 113.301 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -90.59 -19.94 23.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.587 0.232 . . . . 0.0 110.962 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.72 126.24 38.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.766 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -74.03 -16.64 61.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.889 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -51.33 -41.01 60.27 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.657 0.265 . . . . 0.0 111.043 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.01 -29.48 67.66 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.239 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -63.37 -45.36 91.53 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.716 0.293 . . . . 0.0 110.825 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mt -69.13 -42.96 81.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.093 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -55.39 -47.08 76.4 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.483 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -75.94 -33.77 59.84 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.479 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -72.83 81.05 1.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.849 0.357 . . . . 0.0 111.332 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.3 p -107.45 144.92 33.7 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.565 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.05 65.85 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.347 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.732 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.7 OUTLIER -157.83 38.86 0.27 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.417 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.469 ' CG1' ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 161.95 163.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.252 0.621 . . . . 0.0 110.365 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.98 124.65 50.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.47 179.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 pp -147.94 145.28 28.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.089 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 97' ' ' ASP . 3.4 m-85 -90.59 166.59 13.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -153.78 172.33 17.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.134 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -152.31 138.47 18.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.2 t -143.52 137.65 25.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.003 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -102.86 127.64 49.97 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.662 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -117.04 159.19 22.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.902 0.382 . . . . 0.0 111.332 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.8 t -142.15 134.68 28.11 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.711 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 42.3 p -124.59 87.82 2.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.948 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.44 163.2 33.86 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.84 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -160.1 79.42 0.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.889 0.376 . . . . 0.0 111.143 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.79 33.61 1.58 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.352 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.6 ptp -151.37 -36.48 0.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.339 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.1 t -159.02 83.01 0.79 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.431 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -79.8 115.8 19.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.71 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.1 155.11 47.52 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.25 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -125.26 141.75 51.9 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -141.19 129.14 21.88 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -85.3 141.1 30.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.66 114.13 17.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.509 ' HB3' ' CB ' ' A' ' 111' ' ' GLU . 0.5 OUTLIER -94.96 106.46 18.45 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.542 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 25.6 mm -103.15 115.22 44.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.438 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.414 HG23 ' HA ' ' A' ' 113' ' ' VAL . 5.2 t -109.16 110.66 21.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.324 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -86.5 140.08 30.27 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.7 tt -128.16 84.57 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.352 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.429 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -67.62 116.95 8.3 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.889 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.479 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.0 mm-40 -33.54 -31.68 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.732 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.5 m-80 -73.58 36.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.454 0.57 . . . . 0.0 111.727 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.479 ' H ' ' C ' ' A' ' 84' ' ' GLU . 3.7 m -102.04 113.32 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 70.9 m -65.52 174.28 2.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.952 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -49.18 -45.99 34.37 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.933 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -47.81 80.58 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.674 0.273 . . . . 0.0 110.982 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -63.2 -37.72 88.33 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.106 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -50.66 71.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.775 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.96 72.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.542 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.433 ' HD3' ' CE2' ' A' ' 31' ' ' TYR . 0.3 OUTLIER -56.57 -36.87 69.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.248 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.3 -47.5 85.17 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.832 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.85 -46.55 93.89 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.016 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.0 m -63.81 -33.12 74.96 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.784 0.326 . . . . 0.0 110.722 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 59' ' ' PHE . 0.4 OUTLIER -69.78 -31.18 68.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -34.29 74.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.678 0.275 . . . . 0.0 110.897 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.428 HG21 ' N ' ' A' ' 100' ' ' LEU . 7.4 t -83.68 -33.24 25.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.276 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.428 ' N ' HG21 ' A' ' 99' ' ' THR . 21.1 mt -68.08 -47.76 67.38 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.809 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 37.9 t -68.74 -38.02 78.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.366 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -63.23 -39.46 94.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.704 0.287 . . . . 0.0 110.656 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -65.35 -50.61 64.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.971 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.412 HG11 HG21 ' A' ' 105' ' ' VAL . 14.9 p -71.22 -36.26 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.337 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.412 HG21 HG11 ' A' ' 104' ' ' VAL . 26.1 t -118.15 98.94 7.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.937 0.399 . . . . 0.0 110.837 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -100.95 -36.84 8.89 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.008 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -78.15 81.22 4.54 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 110.74 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -130.18 177.07 7.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.698 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -110.07 -52.58 2.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.112 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -154.95 143.77 20.78 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.894 0.378 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.509 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 13.4 pt-20 -148.06 126.53 12.39 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.529 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -143.79 168.01 20.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.39 . . . . 0.0 111.434 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.414 ' HA ' HG23 ' A' ' 80' ' ' THR . 4.7 t -107.09 130.08 59.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.466 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 41.4 mm -127.51 148.27 32.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.132 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.7 p -138.14 30.94 2.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.992 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -136.29 135.01 38.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.682 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.11 85.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.373 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -63.04 -47.68 81.99 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.479 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -69.71 -30.14 67.71 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.853 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -33.12 74.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.765 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -47.46 131.76 13.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.206 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -51.73 -32.63 31.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.884 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -58.19 -45.18 88.01 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.374 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -67.28 -47.34 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.012 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.87 -47.95 89.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -62.18 -41.76 98.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -45.44 93.26 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.727 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.45 -49.78 72.32 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -37.1 82.5 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.099 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -57.86 -39.53 77.97 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.948 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -60.49 -28.99 68.8 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.313 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -102.13 34.85 2.57 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.403 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -63.13 -23.71 66.38 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.369 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -127.95 -134.16 3.85 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.089 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -141.24 29.51 1.81 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.56 0.219 . . . . 0.0 111.448 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 51.42 35.94 15.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 111.416 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -83.82 -44.7 14.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.06 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -77.26 148.8 35.57 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.203 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -160.71 -64.07 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -136.37 17.16 3.17 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.631 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.6 p -100.21 49.41 0.91 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.83 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.91 179.72 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.666 0.27 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -123.51 84.0 2.21 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -104.08 176.79 5.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.448 ' HB ' HD12 ' A' ' 36' ' ' ILE . 10.0 tt -118.16 123.84 72.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.7 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.4 ' HB3' HG11 ' A' ' 37' ' ' VAL . 7.3 t70 -67.4 111.01 3.82 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.424 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -45.36 88.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.33 -44.48 75.9 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.062 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.49 -54.9 29.03 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -58.19 -47.78 82.38 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.092 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -42.02 99.14 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.895 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.41 -49.42 74.56 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.837 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.79 -32.9 74.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.175 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -57.64 10.41 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.146 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -68.5 -31.32 70.49 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.572 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.5 -49.11 64.96 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.141 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.2 t -71.0 -33.82 53.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.833 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -53.88 -35.58 61.73 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.988 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -67.94 126.76 30.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.259 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -97.14 40.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.244 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -139.8 32.11 2.24 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.948 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -138.9 26.98 2.44 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.863 0.331 . . . . 0.0 111.781 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.29 32.1 3.0 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.4 ' CG2' ' HB2' ' A' ' 41' ' ' GLN . 12.5 p -111.45 131.69 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.777 0.322 . . . . 0.0 111.634 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 43' ' ' ALA . 18.0 pt -129.48 -41.55 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.484 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 27.9 p-90 -121.69 159.84 25.72 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.965 0.412 . . . . 0.0 111.802 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 12.4 m -142.84 148.08 20.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.588 178.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.514 ' CG2' ' HB2' ' A' ' 40' ' ' GLU . 1.5 t -120.05 115.46 23.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.477 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.449 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 9.3 m-85 -79.64 121.1 24.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.607 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.71 164.75 17.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.87 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -78.66 113.26 16.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.899 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -132.42 108.93 9.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.664 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.54 37.63 58.11 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.521 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 m 64.38 26.85 13.62 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.706 0.288 . . . . 0.0 111.198 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -146.47 153.32 40.3 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.939 0.399 . . . . 0.0 110.735 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.448 HD12 ' HB ' ' A' ' 5' ' ' ILE . 3.0 mp -84.08 128.88 38.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.4 HG11 ' HB3' ' A' ' 6' ' ' ASP . 19.6 m -145.11 144.92 25.16 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.884 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.416 ' HG3' ' CZ ' ' A' ' 29' ' ' PHE . 36.5 Cg_exo -57.26 149.46 64.2 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -130.35 -153.47 7.73 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 121.21 -0.519 . . . . 0.0 112.467 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.577 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.9 mp0 -23.96 132.64 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.791 0.836 . . . . 0.0 112.74 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.422 ' HB3' HG13 ' A' ' 27' ' ' VAL . 1.7 pt20 -134.13 98.86 4.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.158 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.77 164.69 25.18 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.467 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -88.34 -21.12 24.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.609 0.242 . . . . 0.0 110.805 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.12 115.36 28.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.729 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -68.35 -17.69 64.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.407 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.47 -40.84 27.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.664 0.269 . . . . 0.0 110.695 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -37.48 87.56 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.999 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -67.84 -39.57 83.82 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.06 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 53.7 mt -68.46 -48.09 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.992 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.97 -36.19 76.6 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.685 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -24.61 27.49 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.66 82.39 2.05 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.829 0.347 . . . . 0.0 111.456 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.2 p -92.19 171.64 8.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.259 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.442 ' HB3' ' HG3' ' A' ' 84' ' ' GLU . 7.6 m-20 -86.27 19.06 2.85 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.563 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.636 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -134.79 71.95 1.45 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.674 0.273 . . . . 0.0 110.564 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -174.66 -172.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 120.939 0.399 . . . . 0.0 111.533 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.79 102.67 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.18 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -149.53 177.64 9.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -110.36 171.79 7.25 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.1 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.26 164.17 37.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.394 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -153.82 108.89 3.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.828 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.0 t -119.38 139.28 47.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -93.47 105.12 17.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.454 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -84.69 141.84 30.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 -179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -126.5 121.6 32.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.756 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.7 p -121.04 100.84 7.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.573 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.576 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -159.94 148.97 18.2 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.172 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.499 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.6 OUTLIER -99.29 -177.82 3.72 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.538 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.1 14.53 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.499 ' H ' ' C ' ' A' ' 68' ' ' ASP . 22.4 ptp -120.18 -34.95 3.55 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.486 0.315 . . . . 0.0 111.236 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 m -155.05 147.13 23.66 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 120.642 0.258 . . . . 0.0 110.982 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.576 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 3.5 pttm -124.97 142.59 51.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -137.17 144.23 42.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.74 149.61 31.42 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.122 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -138.88 139.54 38.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.753 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -104.77 123.57 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.878 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -136.64 136.01 38.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.15 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.33 106.59 17.1 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.379 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.0 mt -90.58 121.87 41.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.16 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.434 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 1.7 m -96.29 123.47 39.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.36 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -111.13 134.38 52.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.891 0.377 . . . . 0.0 111.022 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.441 HG21 HD12 ' A' ' 82' ' ' ILE . 39.9 mt -137.75 105.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.031 179.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -68.84 116.57 7.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.624 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.488 ' C ' ' H ' ' A' ' 86' ' ' VAL . 0.1 OUTLIER -38.12 -30.34 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.636 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -72.94 36.24 0.08 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.031 0.444 . . . . 0.0 111.966 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.488 ' H ' ' C ' ' A' ' 84' ' ' GLU . 5.0 m -109.35 127.73 65.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.546 178.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.99 170.45 11.27 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.85 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.03 -42.17 47.38 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.672 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.4 -44.99 93.06 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.854 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -61.69 -41.73 97.97 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.878 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -61.23 -46.06 91.96 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.649 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.24 78.06 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.255 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -55.62 -55.05 36.56 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.856 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -38.55 71.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.58 -45.74 94.2 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.823 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.8 -45.37 36.43 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.668 0.234 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.421 ' HA ' HD11 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -59.76 -38.34 81.54 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.297 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -32.73 69.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.871 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.1 m -70.53 -42.73 70.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.441 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 97' ' ' ASP . 6.4 mt -61.8 -50.07 73.81 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.084 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 13.0 p -62.65 -35.39 70.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.274 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -62.79 -41.79 99.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.714 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -62.83 -37.73 87.94 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.845 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 39.7 t -63.79 -44.89 98.37 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.924 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -121.38 98.55 6.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -95.0 -24.85 16.74 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.555 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -80.16 83.65 5.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.787 0.327 . . . . 0.0 110.89 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -136.23 166.96 22.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.61 -55.35 2.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.318 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -132.74 147.65 52.32 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.288 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -152.0 124.58 8.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.992 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -158.55 161.1 37.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.382 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.434 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 8.7 p -109.31 140.39 28.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.781 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.493 HD13 ' HA ' ' A' ' 120' ' ' LEU . 8.5 mt -131.87 139.37 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 111.337 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.68 -26.24 10.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.947 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -83.9 138.67 33.05 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -35.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.525 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -68.19 -47.45 67.88 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.34 -27.9 68.25 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.204 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 114' ' ' ILE . 1.3 tp -76.37 -28.48 56.79 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.6 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -50.59 135.17 23.39 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.102 0.477 . . . . 0.0 111.164 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.45 -31.65 46.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.121 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.38 -43.79 92.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.802 0.334 . . . . 0.0 110.599 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.38 -48.91 68.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.905 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 15.8 mt -61.96 -37.4 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.25 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.78 -40.49 63.24 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -73.08 -43.02 62.39 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.31 -49.41 74.1 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.185 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.51 -45.47 92.85 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.271 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -65.12 -33.21 75.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.889 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -54.18 -45.27 72.08 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.137 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.15 44.43 29.19 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.055 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.84 49.05 6.69 Favored Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.449 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -77.91 70.16 2.56 Favored Glycine 0 C--N 1.336 0.577 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.355 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -171.92 26.05 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -163.8 26.67 0.08 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.723 0.297 . . . . 0.0 111.082 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -55.69 -42.81 75.75 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.653 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -76.73 151.17 36.15 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.889 0.376 . . . . 0.0 111.267 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -152.87 -64.47 0.16 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.115 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -145.82 18.68 1.46 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.882 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 12.1 t -89.43 -42.04 11.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.034 -179.741 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.767 0.318 . . . . 0.0 111.316 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 m -132.74 113.81 13.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.577 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -103.78 157.61 16.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.487 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.1 tt -128.73 118.83 48.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.471 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HB3' HG12 ' A' ' 37' ' ' VAL . 29.3 t0 -79.97 112.01 16.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.918 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -37.41 58.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -55.37 35.56 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.099 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.469 ' HB2' ' HD2' ' A' ' 38' ' ' PRO . . . -59.53 -49.61 77.11 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.141 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.81 -46.88 84.05 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.899 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtt-85 -62.35 -46.31 89.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.926 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.16 -45.25 79.74 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.796 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.07 -46.52 87.06 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -56.3 -42.24 77.24 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.908 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -43.35 92.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.077 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.3 t -71.38 -31.05 42.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.259 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -39.38 58.91 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.929 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -87.09 134.18 33.53 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.608 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -98.99 27.1 5.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.306 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.42 31.42 5.06 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.395 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.9 t -133.79 23.89 3.96 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 53.9 29.31 9.68 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.6 t -114.46 132.16 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.746 0.308 . . . . 0.0 111.391 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.589 HG12 ' HA ' ' A' ' 43' ' ' ALA . 22.8 pt -129.67 -40.68 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.609 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 24.6 p-90 -123.74 154.24 39.76 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.879 0.371 . . . . 0.0 111.294 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.446 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 6.8 t -138.57 155.05 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.198 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.416 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 0.3 OUTLIER -98.63 169.91 9.17 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.545 179.246 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -150.91 95.87 2.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.995 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -122.01 170.03 10.24 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.969 0.414 . . . . 0.0 111.61 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -80.21 135.87 36.36 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.759 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.513 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.0 m-20 -153.7 116.52 4.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.09 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.83 40.29 75.22 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.928 -0.654 . . . . 0.0 113.014 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m 62.78 28.42 16.47 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.626 0.251 . . . . 0.0 111.494 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.5 t -156.0 149.1 24.39 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.6 mt -78.39 132.24 32.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.171 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.513 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 30.9 m -144.47 154.09 56.18 Favored Pre-proline 0 CA--C 1.531 0.217 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.469 ' HD2' ' HB2' ' A' ' 9' ' ' ALA . 36.5 Cg_endo -64.85 163.45 28.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.429 2.086 . . . . 0.0 112.306 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.416 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -131.18 -153.84 7.69 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.253 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.6 mp0 -36.13 141.74 0.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.445 ' HG3' HG12 ' A' ' 27' ' ' VAL . 8.1 mt-30 -135.71 111.71 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.85 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.75 168.11 34.85 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.543 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.589 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.08 -18.73 29.83 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.723 -0.239 . . . . 0.0 110.956 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.71 119.94 31.35 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.752 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -72.94 -23.11 60.64 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 15.8 tp60 -48.76 -37.33 18.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.637 0.256 . . . . 0.0 110.715 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -33.65 76.51 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.337 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.87 -42.54 63.57 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.687 0.28 . . . . 0.0 111.057 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.6 mt -62.31 -40.55 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.137 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -69.2 -38.35 78.57 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.552 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.97 -42.73 60.04 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.44 -179.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 6.1 m -80.45 84.22 6.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.979 0.419 . . . . 0.0 111.803 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 p -96.89 161.8 13.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.551 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.456 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.5 m-20 -81.89 63.39 6.11 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.123 0.487 . . . . 0.0 111.299 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.708 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.8 t70 -170.08 43.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.741 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 174.1 150.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.525 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.472 ' HB2' ' CG2' ' A' ' 94' ' ' THR . 0.0 OUTLIER -109.9 121.82 46.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.731 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.6 173.38 11.87 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -117.85 172.3 7.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.256 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.37 166.08 31.89 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.47 . . . . 0.0 111.667 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -144.77 112.21 6.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.824 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.5 t -126.14 137.14 58.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.932 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -119.45 124.95 47.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.59 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -111.99 161.8 16.05 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.266 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 m -139.3 113.69 8.99 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.375 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.3 t -121.88 146.05 47.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.067 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.31 169.43 28.96 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.135 -0.555 . . . . 0.0 112.542 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 70' ' ' MET . 15.4 t70 -114.69 79.06 1.22 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.899 0.38 . . . . 0.0 111.331 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 30.4 48.22 0.05 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 179.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 68' ' ' ASP . 15.2 ptp -178.95 -35.42 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.679 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -148.33 123.56 10.2 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.782 0.325 . . . . 0.0 111.173 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.87 129.99 55.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.452 179.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -118.6 138.3 52.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.713 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.6 t -102.41 150.4 23.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -148.16 138.42 22.72 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.947 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -94.07 147.08 23.48 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.552 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.53 142.04 30.97 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.596 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.93 105.15 16.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.389 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 25.4 mm -93.16 113.05 27.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.199 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.3 m -98.77 114.15 26.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.608 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -100.35 137.73 38.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.857 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.528 ' CG2' HG23 ' A' ' 86' ' ' VAL . 40.0 mt -138.57 97.37 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.95 109.7 3.06 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.382 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.46 ' C ' ' H ' ' A' ' 86' ' ' VAL . 36.9 mt-10 -22.23 -46.34 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -179.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.708 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.2 m-80 -70.72 43.68 0.07 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.14 0.495 . . . . 0.0 111.935 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.528 HG23 ' CG2' ' A' ' 82' ' ' ILE . 4.1 t -78.61 145.51 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.277 178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.0 m -83.71 171.28 13.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.02 7.08 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.409 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mp -58.97 -37.3 76.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.72 0.295 . . . . 0.0 110.964 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.69 -34.88 77.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -30.42 71.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.538 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -85.07 -39.0 18.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.975 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.469 ' O ' HG23 ' A' ' 96' ' ' THR . 0.6 OUTLIER -57.0 -33.82 67.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.302 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.472 ' CG2' ' HB2' ' A' ' 57' ' ' ARG . 3.0 p -64.62 -42.09 95.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.543 0.211 . . . . 0.0 110.736 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.48 -49.44 76.65 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.12 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.469 HG23 ' O ' ' A' ' 93' ' ' LYS . 9.9 t -73.64 -30.2 62.8 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 111.505 0.187 . . . . 0.0 111.505 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -58.69 -42.73 89.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.7 0.286 . . . . 0.0 111.039 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -53.77 -32.73 53.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.128 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.9 m -74.98 -41.5 59.41 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.006 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.8 mt -61.66 -49.23 77.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.364 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.65 -37.65 80.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.911 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -61.85 -34.96 76.92 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.042 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -75.18 -47.5 28.03 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.442 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.7 p -66.54 -38.32 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.499 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 43.7 t -127.8 121.5 56.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 120.772 0.32 . . . . 0.0 110.967 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -120.17 3.29 10.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.961 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -89.43 74.55 7.75 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.913 0.387 . . . . 0.0 111.073 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -145.8 147.69 32.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.148 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.82 -41.85 15.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.372 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.28 160.47 43.34 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.813 0.339 . . . . 0.0 111.181 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -150.6 122.64 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.892 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -137.47 166.22 24.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 111.123 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 25.5 t -110.37 139.57 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.631 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 32.7 mm -131.53 151.1 34.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.105 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.1 t -147.1 29.8 0.97 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.017 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -137.52 136.08 37.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.58 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.89 -35.91 82.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.289 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.8 tttm -65.9 -41.87 90.96 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.46 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -73.49 -33.11 64.66 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.59 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.0 mt -61.02 -34.15 74.39 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.432 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -43.43 130.31 5.03 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.333 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -49.69 -36.87 26.64 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.922 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -60.58 -42.6 97.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.893 0.378 . . . . 0.0 110.22 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -69.77 -49.71 50.37 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.952 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.4 mm -55.98 -46.51 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -66.81 -34.7 78.38 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.172 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.3 t -61.97 -48.81 78.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.828 0.347 . . . . 0.0 110.255 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.35 -32.21 71.15 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.712 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.44 -47.47 69.64 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.644 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -44.55 70.27 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.591 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.48 -43.32 77.18 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.735 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.412 ' HA ' ' CE2' ' A' ' 137' ' ' TYR . . . -73.47 89.36 1.66 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 111.183 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 97.16 39.32 4.05 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.54 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -112.94 -86.93 1.59 Allowed Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.472 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 176.07 32.06 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.621 0.248 . . . . 0.0 111.578 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -167.85 30.32 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 110.835 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.412 ' CE2' ' HA ' ' A' ' 132' ' ' ALA . 3.0 t80 -48.5 -39.41 23.1 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.832 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.76 155.98 39.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.807 0.337 . . . . 0.0 110.857 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -161.57 29.59 0.13 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -111.1 11.74 21.96 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.936 0.398 . . . . 0.0 111.384 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.2 p -146.33 38.15 1.04 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.775 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.798 0.332 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -133.99 130.89 38.27 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.735 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -107.98 103.22 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -80.01 113.37 19.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.556 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.446 ' HB3' HG12 ' A' ' 37' ' ' VAL . 16.7 t0 -72.02 106.79 4.42 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -68.26 -40.3 81.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.676 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -60.98 -45.95 92.73 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.65 -57.05 14.61 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.633 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 46.3 t -57.17 -42.83 81.84 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -41.99 96.27 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.906 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.76 -52.85 58.89 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.926 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.43 -33.46 76.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.158 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.96 -57.13 13.4 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.334 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -69.9 -29.81 67.09 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.618 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.46 -48.51 79.3 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.645 0.26 . . . . 0.0 111.128 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.4 -33.74 58.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.45 -18.3 60.66 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.823 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -73.38 70.1 1.2 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 111.249 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.3 18.61 3.46 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.611 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 51.83 69.08 1.26 Allowed Glycine 0 C--N 1.339 0.736 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.465 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 t -71.53 78.4 0.79 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.901 0.381 . . . . 0.0 111.312 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 57.18 28.13 14.59 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.914 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.427 ' CG1' ' HB3' ' A' ' 41' ' ' GLN . 48.2 t -141.33 109.42 2.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.746 0.308 . . . . 0.0 110.849 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.2 pt -108.18 -28.84 2.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.542 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.554 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 43.9 p-90 -128.71 158.15 39.38 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.891 0.377 . . . . 0.0 111.312 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 29.2 m -142.34 143.99 25.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.154 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.562 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 3.6 m -82.38 168.09 17.86 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.472 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.425 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 7.7 m-85 -147.46 108.9 4.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 110.496 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -143.88 148.87 36.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.429 ' HA ' ' O ' ' A' ' 35' ' ' THR . 43.7 p90 -98.18 133.69 42.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.569 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.35 108.44 19.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.211 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.0 -71.37 2.21 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.123 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 p -159.8 33.71 0.18 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.205 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.429 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 3.3 t -145.47 126.39 14.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 33.3 mt -83.94 133.28 29.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.446 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.3 m -152.98 156.28 32.64 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.86 160.05 45.88 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.6 2.2 . . . . 0.0 112.242 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.562 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.69 -146.67 6.09 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.494 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.554 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.29 137.32 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.083 0.553 . . . . 0.0 112.412 -179.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.427 ' HB3' ' CG1' ' A' ' 24' ' ' VAL . 14.3 mt-30 -135.22 114.44 12.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.329 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -149.99 160.94 28.72 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.757 -0.735 . . . . 0.0 113.338 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.12 -25.92 36.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.571 0.224 . . . . 0.0 110.815 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.42 121.37 38.15 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.511 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.92 -20.4 64.23 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -37.15 9.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.748 0.309 . . . . 0.0 111.042 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -42.96 99.48 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.402 ' CE2' ' SG ' ' A' ' 52' ' ' CYS . 56.4 t80 -66.88 -45.28 78.54 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.719 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.415 HD13 HG21 ' A' ' 49' ' ' ILE . 55.0 mt -61.42 -36.14 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.959 179.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -59.5 -47.06 86.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.016 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.88 -17.33 47.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.853 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.402 ' SG ' ' CE2' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -70.86 83.51 0.65 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.115 0.483 . . . . 0.0 111.592 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.2 p -111.09 146.21 37.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.458 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.488 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 2.3 m-20 -78.96 59.94 2.77 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.84 0.352 . . . . 0.0 111.699 -179.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.6 t70 -157.85 36.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.989 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -179.36 174.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.022 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.555 ' HG2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -124.77 133.76 53.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.928 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.39 164.03 32.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.988 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 18.9 m-85 -105.87 166.19 10.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.925 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -143.87 155.52 44.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.578 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.444 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 1.2 t80 -152.07 135.53 16.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.503 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.21 141.93 12.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.855 0.36 . . . . 0.0 111.308 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.469 ' HD2' ' CE2' ' A' ' 76' ' ' PHE . 11.0 ttp180 -108.9 154.44 22.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.439 ' CD1' HD21 ' A' ' 129' ' ' LEU . 71.9 m-85 -125.47 150.47 47.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.1 m -146.8 99.98 3.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.656 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.6 p -105.21 91.26 3.72 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.925 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.31 161.7 32.74 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.823 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -158.83 79.94 0.78 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 111.237 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.41 36.92 1.79 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.215 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.0 ptm -155.03 -37.27 0.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.399 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.3 m -157.88 82.88 0.87 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.552 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.455 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.4 OUTLIER -79.78 100.48 7.97 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.598 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -113.45 125.3 54.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -109.66 146.26 35.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.67 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -139.83 143.63 36.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.156 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.469 ' CE2' ' HD2' ' A' ' 63' ' ' ARG . 5.5 m-85 -119.18 136.14 54.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 110' ' ' LYS . . . -142.55 140.76 31.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.962 0.411 . . . . 0.0 111.718 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.444 ' HG ' ' CD2' ' A' ' 61' ' ' PHE . 1.2 tt -109.15 119.66 40.2 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.241 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 mp -113.33 127.88 70.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 0.0 111.363 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -102.82 132.68 48.83 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.236 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -109.36 123.96 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.902 0.382 . . . . 0.0 111.421 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.9 tt -114.91 100.32 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.861 178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -71.35 73.2 0.75 Allowed Glycine 0 C--N 1.333 0.368 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.932 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 24.11 -75.22 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' A' ' 83' ' ' GLY . 49.5 m-80 -49.0 -18.06 0.26 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 t -36.75 109.24 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 O-C-N 123.229 0.33 . . . . 0.0 111.608 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.8 m -61.3 168.81 2.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.676 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.07 -48.25 86.83 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.467 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.3 tp -57.34 -38.9 74.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.695 0.283 . . . . 0.0 110.533 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.555 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 24.5 mm-40 -68.73 -37.83 79.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.399 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -59.47 -51.45 69.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.431 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.53 87.71 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.94 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.98 -46.0 82.51 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.461 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 63.2 m -60.99 -44.46 97.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.72 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.22 -52.39 49.8 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.703 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.38 -37.43 85.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.59 0.233 . . . . 0.0 110.938 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.406 ' HA ' HD11 ' A' ' 100' ' ' LEU . 1.1 m-20 -57.91 -40.86 81.4 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.945 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -62.46 -29.75 70.75 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.015 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.6 m -67.79 -47.24 69.66 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.722 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.406 HD11 ' HA ' ' A' ' 97' ' ' ASP . 1.4 mt -61.98 -42.54 99.25 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.965 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.96 -31.68 53.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.78 -41.12 96.09 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.932 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.45 -52.68 43.78 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.13 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.29 -34.27 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.3 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 41.1 t -119.29 89.92 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 120.912 0.387 . . . . 0.0 110.713 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -101.52 -24.37 14.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -77.63 84.17 4.0 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.923 0.392 . . . . 0.0 110.841 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.404 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.6 p90 -146.04 164.17 32.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.872 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.52 -47.7 8.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.169 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -165.18 161.86 19.67 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.135 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -150.6 138.89 20.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.789 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -147.0 168.52 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.978 0.418 . . . . 0.0 111.288 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 8.8 p -119.15 139.33 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 38.9 mm -129.69 151.96 36.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.987 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 14.9 m -109.94 -29.28 8.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.244 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -101.42 149.64 23.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.812 0.339 . . . . 0.0 110.872 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -69.44 -21.28 63.74 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.884 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -61.79 -57.74 10.68 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.114 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -75.19 -22.34 58.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.582 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.6 tp -80.23 -25.7 39.46 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.737 -0.21 . . . . 0.0 111.066 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -52.77 144.75 13.62 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.288 0.566 . . . . 0.0 111.667 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -53.38 -33.36 53.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.603 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -41.0 85.4 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.91 0.386 . . . . 0.0 110.446 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -71.34 -45.23 63.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.88 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.7 mt -61.32 -49.09 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.954 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -33.52 70.72 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.284 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.6 t -79.23 -43.95 22.78 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -63.07 -45.67 91.06 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.169 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.439 HD21 ' CD1' ' A' ' 64' ' ' PHE . 0.3 OUTLIER -68.28 -23.81 64.8 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.665 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 20.4 tttm -50.88 -42.91 59.42 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.613 0.244 . . . . 0.0 111.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.02 -66.55 0.88 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.477 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 51.79 34.01 12.34 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.719 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 161.0 53.3 0.02 OUTLIER Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.623 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -92.84 -126.17 4.02 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.232 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -143.81 23.85 1.71 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.5 0.191 . . . . 0.0 111.502 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 50.63 31.85 6.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.524 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.16 -56.39 2.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.898 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -79.6 142.35 35.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.976 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -114.15 -35.66 4.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.449 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.7 14.65 9.87 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.904 0.383 . . . . 0.0 111.634 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 3.9 m -144.61 41.48 1.33 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.608 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.949 -179.923 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.819 0.342 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.0 m -78.08 101.2 6.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.514 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 35' ' ' THR . 9.2 mttp -95.13 169.79 9.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.4 tt -129.33 124.87 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.576 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.33 106.11 5.81 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.645 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -39.05 84.65 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.754 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -52.52 64.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.957 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.469 ' CB ' HG21 ' A' ' 37' ' ' VAL . . . -66.8 -52.96 37.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.293 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.2 m -53.11 -46.96 68.94 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.27 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -65.14 -41.67 94.55 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.716 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.52 75.01 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.665 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.88 99.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.77 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -59.25 -42.11 90.35 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.979 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -66.52 -41.46 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.065 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 tp -71.28 -48.27 51.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.639 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.08 -29.51 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.336 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -61.19 -34.15 74.61 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.624 0.249 . . . . 0.0 110.703 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.56 100.48 1.82 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -6.79 59.62 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.38 -32.12 62.7 Favored Glycine 0 C--N 1.338 0.661 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.876 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.6 t -87.26 175.35 8.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.922 0.391 . . . . 0.0 111.455 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.63 54.79 2.97 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.31 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.432 HG13 ' HB3' ' A' ' 41' ' ' GLN . 26.5 t -132.17 98.53 3.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.703 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -104.61 -30.93 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.536 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 30.4 p-90 -132.28 157.97 43.02 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.881 0.372 . . . . 0.0 111.582 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.44 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -141.63 149.27 20.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.466 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.514 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 90.3 m -88.93 162.47 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.893 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -148.23 96.41 2.62 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.811 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -123.67 152.56 41.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.452 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -105.56 118.07 35.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.95 0.405 . . . . 0.0 111.054 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.11 90.55 0.87 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.43 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.45 -57.52 4.12 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 t -149.66 -35.62 0.17 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.414 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 11.3 t -80.28 130.32 35.12 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.924 0.393 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 33.0 mt -79.29 141.01 15.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.08 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.469 HG21 ' CB ' ' A' ' 9' ' ' ALA . 7.5 p -158.59 138.31 8.59 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.049 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.402 ' HD2' ' CG2' ' A' ' 37' ' ' VAL . 19.4 Cg_endo -59.6 162.61 14.81 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.68 2.253 . . . . 0.0 112.378 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.514 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -131.54 -150.83 6.76 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 121.25 -0.5 . . . . 0.0 112.712 -179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.536 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -38.72 141.44 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.242 0.617 . . . . 0.0 112.47 -179.037 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.432 ' HB3' HG13 ' A' ' 24' ' ' VAL . 19.2 mt-30 -139.32 98.83 3.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.142 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.83 165.86 23.76 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.332 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.445 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.1 -21.92 25.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.627 0.251 . . . . 0.0 110.865 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -97.28 128.06 43.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.536 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -73.95 -20.13 60.46 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.652 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -48.21 -40.74 25.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.828 0.347 . . . . 0.0 110.36 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -39.38 88.23 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.263 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -69.03 -45.22 71.02 Favored 'General case' 0 C--N 1.338 0.066 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.736 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 26.7 mt -57.4 -40.54 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.324 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -68.04 -39.53 83.03 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.03 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -89.98 0.03 57.32 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.5 t -110.03 87.4 2.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.88 0.372 . . . . 0.0 111.425 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.33 176.77 5.59 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.448 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.84 19.58 1.68 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.692 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -133.07 75.68 1.64 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -175.21 -172.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.837 0.351 . . . . 0.0 111.813 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.519 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -166.62 96.31 0.55 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.365 179.725 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 pp -151.92 173.31 14.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.443 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -107.06 163.71 12.76 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.134 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -143.11 161.42 38.24 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.022 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -148.05 126.94 12.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -134.99 138.5 48.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.185 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -102.02 106.4 17.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.497 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -108.92 140.0 43.0 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.994 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 42.4 m -139.39 133.78 31.53 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.928 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.7 p -113.3 89.41 3.07 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.821 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.422 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.29 169.39 36.11 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.845 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -159.87 79.42 0.7 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 111.115 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.99 34.86 2.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.522 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.0 ptt? -152.24 -37.61 0.11 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.389 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.6 t -158.08 85.93 0.89 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.236 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.422 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -79.69 105.27 10.86 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.041 -179.51 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.436 ' O ' ' HA ' ' A' ' 65' ' ' THR . 0.6 OUTLIER -103.47 88.27 3.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.834 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p -91.98 135.23 34.11 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.139 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -146.54 146.23 30.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -99.95 130.79 46.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.417 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -122.75 127.03 48.65 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.292 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.0 tt -100.94 107.2 18.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.382 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -99.83 105.03 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.503 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.9 p -88.95 116.53 27.31 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.847 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -100.25 140.57 34.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.078 0.465 . . . . 0.0 111.82 -179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.416 HG22 HG11 ' A' ' 86' ' ' VAL . 27.3 mt -144.57 101.2 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.653 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.33 124.52 9.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.261 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -33.07 -46.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.692 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.0 m-80 -56.05 -10.92 0.92 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.416 HG11 HG22 ' A' ' 82' ' ' ILE . 12.5 p -51.98 125.68 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.998 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.09 162.84 28.58 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.64 -50.7 52.61 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.813 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.29 -39.51 87.16 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.772 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.463 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 71.6 mm-40 -61.95 -44.58 96.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -57.06 -48.12 79.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.743 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.41 -44.72 89.16 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.647 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -56.58 -54.58 44.28 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.291 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -48.74 -40.17 27.61 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.489 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.26 -52.37 53.0 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.963 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.5 -37.48 86.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.305 . . . . 0.0 110.786 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -70.06 -35.7 74.42 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.195 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -31.79 71.94 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.299 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.0 t -81.02 -33.33 33.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.951 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.0 mt -64.22 -43.81 93.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 39.6 t -68.02 -42.53 85.38 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -37.41 76.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.0 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.12 -42.51 93.87 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.761 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 43.4 t -69.58 -41.34 80.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.909 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 36.3 t -114.1 97.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.949 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -96.18 -22.24 17.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.567 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.6 80.44 5.98 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.965 0.412 . . . . 0.0 110.514 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -129.27 172.91 11.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.734 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.34 -53.95 2.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.531 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.1 125.57 13.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.776 0.322 . . . . 0.0 111.494 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.43 128.35 47.95 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.557 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -144.1 161.75 38.01 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.987 0.422 . . . . 0.0 111.514 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.6 t -100.81 141.99 16.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.392 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.402 HG21 ' N ' ' A' ' 120' ' ' LEU . 31.7 mt -135.94 135.78 50.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 21.3 t -118.58 -15.98 9.51 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.991 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -115.0 151.89 33.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 111.03 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -21.96 66.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.354 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -55.8 22.11 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.576 0.227 . . . . 0.0 110.792 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.452 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 0.6 OUTLIER -73.88 -30.03 62.4 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.402 ' N ' HG21 ' A' ' 114' ' ' ILE . 0.9 OUTLIER -68.72 -25.85 64.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.689 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.04 136.98 56.32 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -53.21 -29.94 34.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.924 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -59.91 -47.16 86.92 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.945 0.402 . . . . 0.0 110.425 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.452 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 30.8 t80 -68.21 -48.36 65.42 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.862 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 59.6 mt -54.61 -43.74 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -43.29 80.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.179 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -47.54 76.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.819 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.63 -42.83 97.7 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.118 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.2 tt -70.23 -31.97 69.63 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.249 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -60.63 3.3 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.738 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.3 mtpt -99.24 -53.43 3.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 60.66 33.09 20.36 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.664 0.269 . . . . 0.0 111.379 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.05 55.88 0.25 Allowed Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.629 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -178.18 173.18 45.7 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 121.215 -0.517 . . . . 0.0 112.395 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 76.34 18.58 1.82 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 111.627 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -152.72 24.24 0.59 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.821 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -65.17 -57.42 8.6 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.542 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -100.02 156.87 16.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.873 0.368 . . . . 0.0 111.269 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -103.42 -25.85 13.11 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.091 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -91.62 10.85 26.39 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 34.1 m -118.49 -39.05 3.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.095 -0.955 . . . . 0.0 111.126 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.694 0.283 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 t -128.4 147.31 50.64 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.2 mttp -99.51 151.42 21.17 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.065 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.509 HG13 ' HB ' ' A' ' 36' ' ' ILE . 3.8 tt -116.71 128.96 73.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.37 106.67 16.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -58.57 -37.34 75.54 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.215 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.27 -49.81 76.41 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.912 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HB2' HG22 ' A' ' 37' ' ' VAL . . . -63.56 -53.89 44.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.307 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -53.54 -43.04 68.09 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.187 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -68.78 -43.07 76.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.64 -45.97 73.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.52 -48.39 75.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.84 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -53.39 -46.57 69.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.855 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -57.52 -43.52 84.36 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.019 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.28 -40.84 81.72 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.077 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 42.8 t -64.69 -42.01 93.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.842 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.6 -41.27 80.9 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.631 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -70.68 124.35 24.07 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.641 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -99.81 30.44 3.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.492 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -136.51 32.39 2.48 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.759 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -130.96 24.55 4.96 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.852 0.326 . . . . 0.0 111.776 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 54.75 28.7 10.57 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.9 t -124.89 114.31 39.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 111.22 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.424 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -107.41 -30.16 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.434 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -131.27 154.87 48.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.878 0.371 . . . . 0.0 111.173 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 34.2 m -142.17 146.77 22.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.261 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.22 170.71 9.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.995 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -148.56 98.96 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.36 179.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.26 -179.57 3.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.013 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 35.2 p90 -140.8 128.56 21.67 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.023 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -96.9 107.16 19.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.397 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.59 -77.56 1.07 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.161 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.72 38.31 0.47 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.753 0.311 . . . . 0.0 111.359 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.6 t -140.77 122.73 15.52 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.898 0.38 . . . . 0.0 110.987 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.509 ' HB ' HG13 ' A' ' 5' ' ' ILE . 4.0 mm -79.47 133.44 29.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.94 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.482 HG22 ' HB2' ' A' ' 9' ' ' ALA . 9.8 p -157.09 139.0 10.11 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.005 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.427 ' HD2' ' CB ' ' A' ' 9' ' ' ALA . 15.6 Cg_endo -56.34 162.75 7.39 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.61 2.207 . . . . 0.0 112.329 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -127.06 -157.96 9.66 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.387 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.5 mp0 -32.63 139.11 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.782 0.833 . . . . 0.0 112.611 -179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -136.4 91.78 2.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.408 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.18 168.5 21.44 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 113.317 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -94.21 -15.23 24.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.754 -0.223 . . . . 0.0 111.187 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -96.72 129.61 44.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -78.42 -17.09 56.88 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.717 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -49.76 -40.57 41.61 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.765 0.317 . . . . 0.0 110.601 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.91 -36.17 81.65 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.928 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -60.7 -46.7 89.38 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.761 0.315 . . . . 0.0 110.788 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 25.1 mt -63.94 -41.47 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -70.42 -40.05 74.07 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.715 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.16 -42.01 69.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.535 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -73.71 81.91 1.57 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.921 0.391 . . . . 0.0 111.265 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 p -117.4 155.83 28.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.56 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.447 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 7.2 m-20 -72.33 69.53 0.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.203 0.525 . . . . 0.0 110.95 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.716 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.5 t70 -170.03 46.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.098 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.404 ' H ' ' HA3' ' A' ' 83' ' ' GLY . 0.0 OUTLIER -175.66 -171.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.885 0.374 . . . . 0.0 111.935 -178.457 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.489 ' HB3' ' CG1' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -160.99 94.51 1.02 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.565 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 177.11 11.58 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.849 0.357 . . . . 0.0 111.675 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.422 ' CE1' ' HB3' ' A' ' 97' ' ' ASP . 28.7 m-85 -109.74 163.43 13.51 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.462 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.42 141.48 26.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.084 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -122.39 135.42 54.69 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.021 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -137.24 136.17 47.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.179 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -101.76 127.1 48.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.826 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -107.56 151.22 25.89 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.184 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.73 128.43 20.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.0 p -141.72 131.23 23.85 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -153.61 137.85 5.98 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.169 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -133.5 137.58 45.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.5 -0.35 . . . . 0.0 110.248 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.448 ' O ' ' HG2' ' A' ' 70' ' ' MET . . . 61.68 30.6 18.56 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.234 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 0.7 OUTLIER 83.74 1.45 0.98 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.435 179.768 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.416 ' O ' ' HA2' ' A' ' 67' ' ' GLY . 0.3 OUTLIER -95.12 83.46 3.92 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.89 0.376 . . . . 0.0 110.75 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.431 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 2.2 ttpm? -86.0 140.5 30.25 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.299 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -145.97 114.84 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.42 151.76 23.75 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.695 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -137.9 144.03 41.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.891 0.377 . . . . 0.0 111.402 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -94.0 134.99 35.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.795 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -135.95 106.27 6.41 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.892 0.377 . . . . 0.0 111.429 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tt -96.35 117.05 30.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.41 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.449 HG22 ' CD2' ' A' ' 120' ' ' LEU . 2.1 mp -118.87 119.94 62.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 120.878 0.37 . . . . 0.0 111.345 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.5 m -88.08 138.58 31.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.235 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.5 t-105 -115.54 125.98 53.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.912 0.387 . . . . 0.0 111.192 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.3 tt -123.59 81.4 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.523 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.447 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -62.48 126.05 36.89 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.572 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.444 ' C ' ' H ' ' A' ' 86' ' ' VAL . 6.2 mm-40 -29.62 -34.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.716 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.7 m-80 -73.93 39.64 0.11 Allowed 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.489 ' CG1' ' HB3' ' A' ' 57' ' ' ARG . 4.7 m -96.46 112.08 27.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.505 178.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.9 170.15 16.8 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.154 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -46.03 -50.65 12.04 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.493 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.67 -35.94 81.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.625 0.212 . . . . 0.0 111.513 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.438 ' HG3' ' HG3' ' A' ' 57' ' ' ARG . 3.0 mp0 -65.09 -39.93 93.87 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.997 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -50.68 -50.42 54.88 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.837 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.22 -38.58 68.96 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -55.33 -40.68 71.48 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.366 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.5 m -53.26 -46.91 69.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.151 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.06 -50.4 65.78 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.001 -0.618 . . . . 0.0 112.624 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.5 p -62.66 -41.22 98.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.562 0.22 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.422 ' HB3' ' CE1' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -66.64 -40.87 88.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.09 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -30.21 68.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.772 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.5 m -71.9 -42.68 66.46 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.774 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -56.52 -56.07 25.88 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.19 -36.55 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.963 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -45.1 89.94 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.907 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.07 -38.05 84.86 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 20.3 t -73.74 -43.54 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.35 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.89 100.25 10.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.926 0.393 . . . . 0.0 111.118 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -103.47 -29.34 11.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.573 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.78 83.81 4.9 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.14 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -138.19 -179.14 5.61 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.736 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -109.6 -67.19 1.0 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.387 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -134.87 144.57 47.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.41 137.05 43.74 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -155.66 173.98 15.95 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.101 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.41 141.01 45.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 30.8 mm -126.22 153.37 34.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.15 -179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 m -117.59 -24.74 7.16 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -117.81 146.81 43.58 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.941 0.4 . . . . 0.0 111.168 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -62.57 -28.04 69.6 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.594 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.87 -45.76 91.47 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.667 0.27 . . . . 0.0 110.886 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.55 -31.5 53.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.8 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.449 ' CD2' HG22 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -79.76 -2.23 42.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.732 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.07 132.23 53.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.931 0.396 . . . . 0.0 110.523 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.39 -37.76 49.93 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.609 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.5 -43.1 99.46 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.28 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -67.94 -51.54 46.43 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.834 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.437 HD11 ' O ' ' A' ' 120' ' ' LEU . 63.7 mt -57.71 -50.44 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -55.05 -42.09 72.27 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.185 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -40.69 94.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.045 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -63.14 -56.8 13.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.8 pp -63.81 -23.54 67.4 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.609 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -82.47 -29.38 30.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.421 0.153 . . . . 0.0 110.911 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.41 -55.22 4.44 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -131.98 44.51 2.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.88 0.371 . . . . 0.0 111.531 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -120.68 30.29 5.58 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.44 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -154.69 -101.62 0.2 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.505 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -166.15 41.16 0.06 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.653 0.264 . . . . 0.0 111.398 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 46.76 44.38 14.0 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 111.229 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -65.89 -49.76 66.91 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.225 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -95.46 148.76 22.13 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.028 0.442 . . . . 0.0 111.134 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -147.15 -66.42 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.706 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -141.56 18.19 2.19 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.552 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 13.0 t -121.85 37.98 4.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.324 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.355 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.77 0.319 . . . . 0.0 111.282 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 t -136.29 143.66 44.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.694 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -179.55 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.565 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -130.72 133.32 63.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.747 0.308 . . . . 0.0 111.16 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -83.13 96.17 8.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.37 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -59.83 -42.92 94.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.244 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.98 -49.81 74.62 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.323 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.404 ' CB ' HG22 ' A' ' 37' ' ' VAL . . . -70.27 -50.94 34.49 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 40.8 m -55.35 -42.9 74.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -66.11 -47.23 74.85 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.516 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.28 -44.19 71.68 Favored 'General case' 0 CA--C 1.527 0.06 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.894 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.62 -37.48 84.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.252 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -55.13 -60.07 3.89 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.15 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -63.96 -29.48 70.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.526 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.0 tt -62.55 -44.54 96.07 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.714 0.293 . . . . 0.0 110.603 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 52.3 t -68.2 -34.63 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.58 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -60.3 -35.99 76.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.72 123.59 25.2 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.412 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.02 41.99 1.11 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.321 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.26 24.16 3.11 Favored Glycine 0 CA--C 1.521 0.458 0 C-N-CA 120.841 -0.695 . . . . 0.0 113.153 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.46 27.32 2.81 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 117.053 0.427 . . . . 0.0 111.74 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.08 34.96 4.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.485 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.2 p -118.34 117.77 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.519 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.55 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -121.57 -31.56 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.51 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 32.2 p-90 -130.87 158.42 40.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.951 0.405 . . . . 0.0 111.384 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 14.5 m -144.52 145.18 21.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.23 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 39' ' ' GLY . 16.7 p -105.7 100.23 9.8 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.812 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.47 ' HB2' ' O ' ' A' ' 59' ' ' PHE . 3.8 m-85 -78.89 109.62 13.34 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.666 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -128.45 135.58 49.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.593 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -91.69 123.7 35.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.98 123.33 45.69 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.715 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.1 -83.04 0.74 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.357 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.94 31.06 0.56 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.5 t -149.82 139.22 21.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.744 0.307 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 7.0 mt -85.09 137.77 20.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.901 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.404 HG22 ' CB ' ' A' ' 9' ' ' ALA . 10.0 p -155.15 141.26 12.96 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.499 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.433 ' HG3' ' CZ ' ' A' ' 29' ' ' PHE . 37.8 Cg_exo -57.56 154.34 36.92 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.555 2.17 . . . . 0.0 112.515 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -128.45 -155.74 8.75 Favored Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 121.325 -0.464 . . . . 0.0 112.082 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.568 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.5 mp0 -24.52 130.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.727 0.811 . . . . 0.0 112.643 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -131.69 98.13 4.4 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.32 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.85 164.33 24.98 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.482 -0.866 . . . . 0.0 113.32 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.55 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -89.67 -20.66 23.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.62 0.248 . . . . 0.0 110.889 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.81 126.49 37.91 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.795 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 12.9 t80 -70.79 -19.13 62.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.671 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -46.98 -41.94 17.12 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.745 0.307 . . . . 0.0 110.643 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.89 -36.68 82.83 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.937 178.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -58.68 -49.34 77.93 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.099 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.3 mt -70.85 -42.61 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.67 -45.43 94.16 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.027 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -76.39 -31.01 57.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.8 m -75.29 84.55 2.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.056 0.455 . . . . 0.0 111.5 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p -93.17 169.67 10.22 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.15 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -85.46 17.43 3.19 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.674 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -133.67 67.86 1.51 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.296 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.404 ' O ' ' N ' ' A' ' 83' ' ' GLY . 0.0 OUTLIER -177.35 -172.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.386 -179.096 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.409 ' HD3' HG11 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -159.06 114.91 2.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.778 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 pp -158.31 154.06 26.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.827 0.346 . . . . 0.0 111.537 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.47 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 1.5 m-85 -107.05 98.98 8.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.407 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -107.92 157.41 18.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.504 ' HB3' ' HA ' ' A' ' 78' ' ' LEU . 31.7 p90 -152.37 164.29 37.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.262 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.4 t -137.41 152.54 27.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.364 -179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -113.26 104.11 12.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.633 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -103.7 173.33 6.35 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.44 114.05 19.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.274 179.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -89.18 91.55 8.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.6 178.26 36.68 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.784 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -159.7 79.45 0.71 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.896 0.379 . . . . 0.0 111.247 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 42.68 39.58 1.69 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.499 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.57 -36.18 0.06 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.611 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.5 m -156.58 81.75 0.96 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.819 0.342 . . . . 0.0 110.947 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.412 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 14.8 pttm -83.51 102.06 11.86 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.844 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -105.56 133.29 50.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.63 135.68 33.69 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.839 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HD3' ' HB3' ' A' ' 109' ' ' ALA . 24.5 mttm -151.73 146.33 25.68 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.953 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -92.98 170.68 9.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.116 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -154.87 105.54 2.58 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.504 ' HA ' ' HB3' ' A' ' 61' ' ' PHE . 7.4 mt -80.99 134.64 35.73 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.203 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.4 mt -129.8 105.43 12.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.027 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.417 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.3 OUTLIER -80.23 97.04 6.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.208 179.601 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -89.22 135.03 33.79 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 41.4 mt -141.58 101.4 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.78 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 56' ' ' VAL . . . -68.08 117.06 8.17 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.026 -0.606 . . . . 0.0 112.221 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.468 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.2 mt-10 -32.04 -40.3 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -179.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.674 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.0 m-80 -71.28 42.0 0.07 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 111.942 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.468 ' H ' ' C ' ' A' ' 84' ' ' GLU . 2.7 m -95.49 135.2 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.491 178.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.16 164.49 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.47 83.47 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.024 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 tp -66.46 -32.14 73.32 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.622 0.211 . . . . 0.0 111.317 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -59.25 -40.21 85.25 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.959 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -40.45 80.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.18 -39.36 40.99 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -58.45 -46.32 86.79 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.011 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -42.28 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.193 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.43 -46.65 93.57 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.191 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.1 -43.13 68.32 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.646 0.26 . . . . 0.0 110.837 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.6 -38.79 88.88 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.422 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.73 -30.62 70.09 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.681 0.277 . . . . 0.0 110.664 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 23.3 m -71.54 -41.82 68.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.412 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.7 mt -63.33 -51.24 66.81 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.39 -30.58 49.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.312 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -65.55 -45.12 84.61 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.638 0.256 . . . . 0.0 110.676 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -38.69 81.99 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.831 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 26.2 t -78.26 -37.04 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.971 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -129.8 83.31 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.94 0.4 . . . . 0.0 110.751 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.0 -35.63 7.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.196 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.97 77.83 2.85 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.456 ' CD2' HD12 ' A' ' 78' ' ' LEU . 4.4 p90 -124.73 179.39 5.0 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.505 ' HB3' ' HD3' ' A' ' 75' ' ' LYS . . . -92.17 -59.36 2.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.5 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.85 154.29 51.22 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.751 0.31 . . . . 0.0 111.359 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -148.88 135.6 19.7 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.174 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -160.44 159.32 30.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.927 0.394 . . . . 0.0 111.292 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.417 HG12 ' HB ' ' A' ' 80' ' ' THR . 2.6 m -100.3 147.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.992 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 59.6 mt -142.18 140.62 29.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.956 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 54.6 m -140.49 31.57 1.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -145.8 134.57 22.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.488 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -34.06 74.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.948 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -69.08 -41.09 78.0 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.681 0.277 . . . . 0.0 110.485 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.71 -32.85 64.11 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.666 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -24.94 64.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.577 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.91 135.2 12.66 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.045 0.45 . . . . 0.0 111.336 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -50.79 -33.74 24.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.094 -179.538 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -38.34 73.22 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 110.309 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -76.14 -46.2 29.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.714 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 29.3 mm -60.19 -51.47 72.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.225 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.0 -42.79 95.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.684 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.1 t -62.78 -43.36 99.01 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.571 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.02 -42.44 90.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.092 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.2 tp -64.42 -43.14 95.29 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.446 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 32.7 tttp -63.92 -46.71 83.59 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.26 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -73.55 -50.9 19.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.146 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.36 41.3 32.05 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.311 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 70.51 43.76 60.22 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.535 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -83.4 158.96 36.43 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.351 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -102.78 25.81 8.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.511 0.196 . . . . 0.0 111.2 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 50.85 47.15 25.14 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 120.909 0.385 . . . . 0.0 110.955 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.42 -55.97 27.14 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.522 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -86.19 159.46 19.48 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.205 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -171.47 -62.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.989 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -114.15 17.07 17.93 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.714 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 2.6 m -90.5 55.88 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.953 0.406 . . . . 0.0 110.894 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.943 179.891 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 67.32 118.59 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.142 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -88.62 150.81 22.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.072 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 tt -120.86 124.3 72.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.596 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.08 112.92 9.57 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.911 0.386 . . . . 0.0 110.806 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.24 -42.97 65.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.925 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -57.06 -51.45 69.22 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.019 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.437 ' HB2' ' HD2' ' A' ' 38' ' ' PRO . . . -61.15 -50.78 71.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.3 t -57.35 -44.24 84.13 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.211 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -42.0 91.31 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.827 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.35 -47.91 68.97 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.747 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.17 84.6 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.666 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -59.26 -37.58 77.95 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.124 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -69.98 -44.25 69.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.284 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -46.88 67.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.102 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.92 -24.91 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.39 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -39.84 66.68 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.881 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.39 114.52 6.15 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.571 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -95.55 42.16 1.09 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.235 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.66 31.73 2.37 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.719 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 t -137.82 177.54 7.8 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.842 0.353 . . . . 0.0 111.1 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.34 55.03 3.32 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.04 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.2 t -142.59 125.0 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.427 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -127.01 -29.28 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.405 ' HB2' HG21 ' A' ' 62' ' ' VAL . 32.7 p-90 -132.96 157.65 44.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.952 0.406 . . . . 0.0 111.727 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 2.3 t -139.07 150.52 23.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.255 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.7 m -90.99 159.97 15.87 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.492 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -145.29 93.16 2.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.208 0.528 . . . . 0.0 110.558 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -113.31 179.14 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -143.78 130.32 20.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.979 0.419 . . . . 0.0 111.427 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.8 -149.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.271 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.4 83.17 0.06 OUTLIER Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.558 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m 65.42 49.62 1.84 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.58 0.352 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.7 t -164.07 113.44 1.21 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.138 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 31.2 mt -85.68 139.75 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.6 m -156.57 154.5 27.04 Favored Pre-proline 0 C--O 1.233 0.185 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.28 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.437 ' HD2' ' HB2' ' A' ' 9' ' ' ALA . 44.7 Cg_endo -67.31 166.06 24.73 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.539 2.159 . . . . 0.0 112.255 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -139.1 -147.02 5.04 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.566 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.7 mp0 -31.96 133.33 0.1 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.356 0.662 . . . . 0.0 112.334 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -136.37 93.97 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.642 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.12 168.61 26.02 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.098 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -86.82 -19.44 28.99 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.573 0.225 . . . . 0.0 110.799 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -89.95 112.14 23.43 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -66.72 -23.1 66.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.768 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -48.7 -35.04 13.11 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.678 0.275 . . . . 0.0 110.792 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 -38.78 90.81 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.052 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -70.97 -38.9 72.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.576 0.227 . . . . 0.0 110.926 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.0 mt -62.93 -40.28 88.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.795 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -45.9 85.21 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.359 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -31.63 67.89 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.468 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.442 ' HB3' ' CD1' ' A' ' 120' ' ' LEU . 1.8 m -74.01 83.94 1.76 Allowed 'General case' 0 C--O 1.233 0.184 0 CA-C-O 120.971 0.415 . . . . 0.0 111.182 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.2 p -100.29 -176.97 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.075 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.25 18.08 2.31 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.853 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.537 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 47.9 t0 -144.09 79.59 1.62 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.854 0.359 . . . . 0.0 110.219 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -175.59 -175.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.39 -179.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.57 77.2 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.073 0.463 . . . . 0.0 110.671 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -132.38 170.95 14.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.463 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -106.2 174.88 5.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.48 157.76 42.74 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.255 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -135.3 121.09 19.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.799 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.405 HG21 ' HB2' ' A' ' 26' ' ' TRP . 16.2 t -135.77 127.24 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.102 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.16 118.45 26.58 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.471 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -106.3 154.14 21.18 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.863 0.364 . . . . 0.0 111.662 -179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 t -139.12 129.74 25.95 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.5 p -123.91 104.44 8.93 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.051 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.416 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.24 167.98 35.71 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.584 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -153.33 79.6 1.17 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.923 0.392 . . . . 0.0 111.167 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 37.91 44.47 0.61 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.639 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.4 ptt? -165.31 -37.4 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.494 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 p -152.39 87.44 1.32 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.416 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 18.3 mtmt -84.33 114.84 22.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.17 163.43 16.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 t -139.26 144.67 38.51 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.872 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.19 150.71 39.74 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.098 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.404 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 11.6 m-85 -105.55 116.97 32.84 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.002 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.09 123.62 50.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.822 0.344 . . . . 0.0 111.428 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.424 ' HB3' ' CB ' ' A' ' 111' ' ' GLU . 3.5 tp -98.18 104.65 16.7 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.337 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 38.6 mm -85.68 100.06 8.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 86.5 m -84.8 108.77 17.64 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.31 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 66.5 t-105 -95.29 138.78 32.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.967 0.413 . . . . 0.0 111.435 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.7 tt -141.1 88.02 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.831 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.46 123.37 33.13 Favored Glycine 0 C--N 1.336 0.563 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.442 ' C ' ' H ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -38.57 -39.83 0.52 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -178.282 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.537 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.9 m-80 -73.75 42.96 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.226 0.536 . . . . 0.0 111.549 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.442 ' H ' ' C ' ' A' ' 84' ' ' GLU . 8.1 p -96.59 135.61 30.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.766 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 m -71.33 157.87 37.34 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.89 -42.83 87.11 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.987 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mt -58.85 -43.11 90.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.638 0.256 . . . . 0.0 111.045 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.92 -33.78 76.34 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.194 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -52.74 33.57 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.975 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.47 -36.44 78.97 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 179.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -43.28 69.82 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -49.19 -46.83 46.11 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.16 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.62 -45.85 93.61 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.373 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 21.8 m -62.54 -46.57 87.79 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.71 0.29 . . . . 0.0 110.877 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.469 ' HA ' HD13 ' A' ' 100' ' ' LEU . 62.8 m-20 -61.03 -37.29 82.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -57.19 -34.09 68.15 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.709 0.29 . . . . 0.0 110.637 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.7 m -72.66 -43.39 63.23 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.624 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 97' ' ' ASP . 37.9 mt -58.31 -47.13 84.66 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 38.8 t -64.64 -38.28 82.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.873 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -38.18 90.14 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.97 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -63.74 -38.93 92.96 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.758 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 t -81.59 -42.86 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.046 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -108.75 102.72 14.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.904 0.383 . . . . 0.0 110.984 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mp0 -100.93 -28.86 12.53 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.339 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -80.57 78.7 7.28 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.006 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.404 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 26.1 p90 -133.88 160.47 37.57 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.6 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -97.94 -61.89 1.32 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.437 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.87 149.54 33.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.424 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -144.93 129.46 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -144.02 161.78 37.89 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.97 0.414 . . . . 0.0 111.261 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.433 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 14.5 p -101.18 140.79 19.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.034 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 15.9 mt -133.63 148.39 30.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.7 m -131.16 26.42 4.87 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.228 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -134.19 138.14 44.92 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.606 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -37.06 80.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.006 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -43.27 99.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -69.61 -31.56 69.75 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.613 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.442 ' CD1' ' HB3' ' A' ' 52' ' ' CYS . 17.1 mt -62.25 -31.96 72.59 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.969 179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -46.17 127.62 8.83 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -49.8 -41.65 45.06 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.647 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -56.2 -42.7 77.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.96 0.409 . . . . 0.0 110.278 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -64.51 -48.82 73.72 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 31.6 mt -59.26 -45.58 92.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -44.02 72.85 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.861 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.9 t -63.07 -43.16 99.37 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.744 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -52.23 65.5 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 mp -61.12 -31.88 71.58 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.717 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -93.77 18.5 10.18 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt -110.96 -48.89 3.07 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.618 0.247 . . . . 0.0 110.961 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -79.59 72.81 6.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.507 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 107.32 48.92 0.89 Allowed Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.435 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -161.94 50.13 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.751 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -164.43 23.41 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -174.19 32.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.713 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -69.24 -44.54 71.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.546 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -112.04 153.39 26.94 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.018 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -171.11 34.84 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.391 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -133.1 14.85 4.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.672 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.9 t -158.72 -41.33 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.512 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.13 -179.959 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.921 0.391 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m -125.06 140.12 53.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.485 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -129.39 170.13 14.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.151 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -124.48 129.38 73.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.683 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.468 ' HB2' HG12 ' A' ' 37' ' ' VAL . 4.7 m-20 -81.26 112.57 18.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -68.55 -40.98 80.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.753 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.52 -47.07 76.84 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.032 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.49 -54.15 18.73 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.266 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 m -52.86 -47.88 67.47 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.433 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -67.46 -38.62 84.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.07 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.34 -50.31 71.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.021 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.52 93.13 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.925 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -55.66 -44.51 77.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -57.44 -42.9 83.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.911 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -39.39 93.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.944 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.7 t -64.56 -35.15 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.129 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -38.03 63.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.048 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -71.3 114.31 9.24 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.544 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -97.58 26.44 5.0 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.407 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -108.15 -29.18 4.38 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.902 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.1 t -88.6 167.28 13.51 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.888 0.375 . . . . 0.0 111.479 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.7 58.43 2.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.89 107.07 5.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.948 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.1 pp -112.69 -29.58 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.742 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -127.31 160.22 32.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.998 0.427 . . . . 0.0 111.391 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.452 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 2.6 t -139.42 149.77 22.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.437 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 60.5 m -89.01 161.92 16.32 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -149.0 93.45 2.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.676 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 ptmm? -132.38 142.74 49.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -85.57 133.34 34.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.058 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.24 110.14 22.23 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.184 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.87 -71.08 2.79 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.932 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.4 p -162.36 30.52 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.585 0.231 . . . . 0.0 111.204 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.414 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 37.4 p -144.33 123.95 13.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.783 0.325 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.3 mp -72.73 130.08 35.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.85 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.468 HG12 ' HB2' ' A' ' 6' ' ' ASP . 10.6 m -151.78 145.7 18.01 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.35 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.413 ' HA ' ' O ' ' A' ' 28' ' ' THR . 29.2 Cg_exo -62.09 168.35 9.28 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.568 2.179 . . . . 0.0 112.46 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.437 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -140.33 -145.9 4.73 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.598 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.6 mp0 -34.22 137.92 0.1 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.353 0.661 . . . . 0.0 112.582 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.452 ' HG2' HG12 ' A' ' 27' ' ' VAL . 4.9 mt-30 -134.76 96.82 3.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.002 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.13 163.13 25.1 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.437 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -86.4 -22.37 26.62 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.719 -0.241 . . . . 0.0 110.927 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -94.8 113.38 25.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.129 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -64.36 -20.1 65.9 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -46.46 -38.59 9.37 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.704 0.287 . . . . 0.0 110.746 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -42.01 97.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.208 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -69.07 -39.46 79.09 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.685 0.278 . . . . 0.0 110.713 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 25.7 mt -63.63 -34.93 70.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.067 179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.29 -25.02 25.71 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.625 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -25.41 26.33 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.596 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.6 p -75.07 66.76 1.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.892 0.377 . . . . 0.0 111.513 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -72.73 149.72 43.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.914 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -80.56 56.06 2.5 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.453 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.588 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.0 OUTLIER -161.31 39.74 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.901 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -175.97 152.89 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.304 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.469 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -112.6 129.71 56.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.407 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 pp -160.47 175.1 13.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.037 0.446 . . . . 0.0 111.782 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -111.3 178.83 4.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.924 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.6 159.88 42.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.033 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.401 ' CZ ' HG12 ' A' ' 105' ' ' VAL . 1.3 t80 -149.02 118.66 6.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.835 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.4 p -149.97 139.4 15.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.791 0.329 . . . . 0.0 111.206 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 5.1 ptm180 -120.94 152.61 38.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -139.19 150.8 45.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.055 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.0 t -131.97 128.24 38.02 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.651 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.6 p -117.08 93.59 4.25 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.998 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.435 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.5 172.66 36.93 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.583 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -159.88 79.53 0.7 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.123 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.25 28.79 1.07 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.577 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -146.39 -34.77 0.28 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.372 179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.22 79.78 0.68 Allowed 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.893 0.378 . . . . 0.0 110.462 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.435 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -82.04 99.42 9.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.796 -179.811 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.03 104.22 13.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.21 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.21 129.91 50.27 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmpp? -135.7 160.65 37.86 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.308 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.501 ' CD2' ' HB3' ' A' ' 63' ' ' ARG . 81.8 m-85 -112.02 163.12 14.63 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.1 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.92 126.58 10.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.354 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.459 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 4.6 mp -100.14 112.92 25.24 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.322 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 16.4 mt -104.11 139.6 24.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.387 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 15.2 m -109.23 125.86 52.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.296 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -110.11 141.79 42.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.962 0.41 . . . . 0.0 111.562 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.4 mt -139.59 101.88 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.888 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -75.03 90.45 0.79 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 113.832 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 19.09 -73.15 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 178.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.588 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 21.1 m-80 -41.58 -26.46 0.07 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.072 0.549 . . . . 0.0 112.183 -178.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.452 HG23 ' HB3' ' A' ' 57' ' ' ARG . 16.6 t -44.62 104.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 m -69.16 173.52 5.53 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.01 0.433 . . . . 0.0 111.909 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.97 -45.32 93.88 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.554 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -41.68 71.25 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.854 0.359 . . . . 0.0 110.65 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.469 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.8 mp0 -65.85 -36.34 83.19 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.542 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -46.8 81.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.485 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.35 98.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.504 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -59.06 -38.6 79.76 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.59 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 28.6 m -63.89 -39.47 94.27 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.719 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -60.89 -46.21 94.99 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.331 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -40.99 98.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.601 0.239 . . . . 0.0 110.649 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -65.91 -38.0 87.55 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.889 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -56.86 -33.67 67.05 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.783 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.5 m -74.83 -41.39 59.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.432 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.76 -46.06 91.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.016 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 23.3 t -66.14 -40.87 88.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.769 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -57.2 -42.38 81.15 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -65.32 -41.13 94.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.718 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 38.2 t -70.44 -48.86 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.977 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.401 HG12 ' CZ ' ' A' ' 61' ' ' PHE . 18.2 t -113.21 107.27 22.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -107.77 -22.44 12.47 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.853 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -75.69 79.43 2.65 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.827 0.346 . . . . 0.0 111.379 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -143.37 159.7 41.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.723 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -87.48 -58.86 2.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.162 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.6 pttp -150.18 172.63 15.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.275 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.459 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 10.3 pt-20 -153.93 150.44 28.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.226 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -160.18 165.99 30.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.229 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.4 p -108.39 145.34 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.251 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 40.9 mt -135.17 146.46 30.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.692 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.7 p -138.4 29.03 2.45 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.297 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -144.0 135.25 25.66 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.663 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -38.39 81.62 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -65.53 -46.76 78.31 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.703 0.287 . . . . 0.0 110.758 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -69.37 -30.33 68.3 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.76 -23.09 61.53 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.411 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -48.22 138.44 9.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.169 0.509 . . . . 0.0 111.795 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -36.69 34.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.054 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.57 -39.76 71.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.488 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -71.25 -46.3 61.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.087 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mt -61.94 -47.9 91.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.191 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -38.33 90.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.246 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.7 t -67.54 -43.48 80.63 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.554 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -64.52 -45.13 88.56 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.106 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -34.1 75.78 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.33 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.67 -29.45 65.78 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.387 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.18 -76.85 0.46 Allowed 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.106 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 55.74 60.47 3.28 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -107.46 -49.26 0.87 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.768 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -78.05 74.56 2.0 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.809 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -172.76 26.91 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -165.5 26.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.264 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -60.51 -62.8 1.6 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.425 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -128.44 -165.74 1.54 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.073 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 66.36 26.93 10.13 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.713 0.292 . . . . 0.0 111.436 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -138.86 16.73 2.67 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 77.2 p -136.15 -49.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.719 179.795 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.848 0.356 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.78 104.25 12.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.778 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -111.24 176.87 4.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.821 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tt -134.22 128.47 52.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.027 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -81.5 94.73 6.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 1.4 mttm -60.99 -45.31 95.3 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.268 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -54.39 -44.99 72.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.094 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.414 ' CB ' HG22 ' A' ' 37' ' ' VAL . . . -73.15 -50.47 22.49 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.365 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 m -56.11 -43.69 78.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.28 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -69.68 -46.47 65.99 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.44 -43.83 62.15 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.69 0.281 . . . . 0.0 111.155 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.35 -36.4 66.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -58.82 -55.86 29.63 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.897 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -67.53 -31.66 71.91 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.84 -49.77 55.59 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.654 0.264 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.6 t -69.0 -23.79 27.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -52.5 -36.74 55.88 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -75.64 120.1 20.58 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.285 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -91.92 40.08 1.03 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.527 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -146.84 34.65 1.33 Allowed Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.944 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.63 32.79 3.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.784 0.292 . . . . 0.0 111.528 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 55.01 29.59 12.62 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 p -125.71 118.21 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.875 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.63 -33.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.449 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.7 p-90 -131.77 157.68 43.19 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.963 0.411 . . . . 0.0 111.041 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.493 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 17.4 m -145.83 151.99 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.52 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.535 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 40.1 m -90.5 162.06 15.22 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.709 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -146.61 91.22 2.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.173 0.511 . . . . 0.0 110.461 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.91 165.54 14.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.912 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -103.13 123.18 46.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.06 0.457 . . . . 0.0 111.279 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.33 114.8 24.82 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.12 38.62 59.28 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.094 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.5 p 69.28 22.39 6.67 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.708 0.403 . . . . 0.0 111.758 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.7 p -136.58 130.46 32.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 0.0 111.24 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.4 mm -68.93 130.26 33.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.983 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.414 HG22 ' CB ' ' A' ' 9' ' ' ALA . 5.4 p -150.87 138.77 12.4 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.916 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -55.98 162.47 7.1 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.493 2.129 . . . . 0.0 112.579 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.535 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -133.05 -149.29 6.12 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.596 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.2 mp0 -37.08 137.51 0.34 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.322 0.649 . . . . 0.0 112.605 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -136.91 103.03 5.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.169 179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.27 164.52 26.9 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.268 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.23 -22.64 35.76 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.675 0.274 . . . . 0.0 110.844 179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -94.92 110.51 22.39 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -66.86 -19.07 65.67 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.67 -37.76 29.96 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.687 0.28 . . . . 0.0 110.674 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -36.42 83.93 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.483 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.408 ' CZ ' ' SG ' ' A' ' 52' ' ' CYS . 61.4 t80 -67.47 -52.13 42.98 Favored 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.842 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.7 mt -59.09 -35.08 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.188 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.3 -47.03 74.92 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.315 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.73 -42.62 50.12 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.374 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.408 ' SG ' ' CZ ' ' A' ' 48' ' ' PHE . 4.5 m -77.02 80.55 3.55 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 111.15 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.4 p -108.82 173.09 6.47 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.77 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.605 ' HB3' ' HB2' ' A' ' 84' ' ' GLU . 12.4 m-20 -75.2 69.05 2.02 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.029 0.442 . . . . 0.0 111.284 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.408 ' HA ' ' OD1' ' A' ' 85' ' ' ASN . 1.3 t70 -178.55 47.7 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.329 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.453 ' H ' ' HA3' ' A' ' 83' ' ' GLY . 0.0 OUTLIER -177.26 -175.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.914 -179.21 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.48 113.08 3.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.698 0.285 . . . . 0.0 111.224 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.4 pp -160.61 170.91 19.89 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.9 0.381 . . . . 0.0 111.637 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -105.65 179.36 4.29 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.722 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.0 172.64 17.17 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.814 0.34 . . . . 0.0 111.576 -179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.414 ' CE2' HG11 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -148.33 133.91 18.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.183 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.405 HG23 ' HB2' ' A' ' 26' ' ' TRP . 15.6 t -143.74 133.25 20.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.21 112.43 25.1 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.485 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -98.26 146.94 25.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.952 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.1 m -146.24 97.04 2.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.763 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.9 p -98.98 143.06 29.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.501 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 72' ' ' LYS . . . -148.54 139.12 7.39 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.464 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -124.15 130.63 52.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.439 -0.38 . . . . 0.0 110.026 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 70' ' ' MET . . . 61.47 31.72 18.97 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.5 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER 84.84 -1.53 0.9 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.298 0.639 . . . . 0.0 112.305 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.8 m -95.24 85.91 4.41 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.788 0.327 . . . . 0.0 110.688 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.492 ' HA ' ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -96.2 148.57 22.58 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.565 -179.577 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -139.57 126.23 20.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.358 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.8 t -86.96 148.26 25.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.189 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.05 129.64 16.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.805 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -85.5 126.7 34.04 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.595 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.21 129.33 39.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.479 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.44 141.84 29.25 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.218 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 27.2 mt -125.35 122.16 62.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.128 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.403 ' HB ' HG12 ' A' ' 113' ' ' VAL . 7.3 m -104.92 105.9 16.15 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.11 179.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -88.98 121.93 31.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.93 0.395 . . . . 0.0 111.523 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 tt -111.38 100.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.706 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.453 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -67.97 83.8 0.17 Allowed Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.825 -0.625 . . . . 0.0 114.109 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.605 ' HB2' ' HB3' ' A' ' 54' ' ' ASP . 2.3 mm-40 19.6 -81.34 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 178.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.408 ' OD1' ' HA ' ' A' ' 55' ' ' ASP . 5.6 p30 -66.51 30.83 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -177.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.441 ' H ' ' C ' ' A' ' 84' ' ' GLU . 3.0 m -64.3 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 161.46 0.5 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.92 -48.63 57.4 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.484 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.55 -33.27 72.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.696 0.284 . . . . 0.0 110.947 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -70.88 -44.78 65.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.314 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -57.69 -47.95 80.92 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.813 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.6 -39.3 93.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.892 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.13 -39.42 86.21 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.063 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -40.8 71.11 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.546 0.212 . . . . 0.0 110.656 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.14 -50.27 57.91 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.595 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -45.84 83.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.87 0.335 . . . . 0.0 110.894 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.465 ' HA ' HD13 ' A' ' 100' ' ' LEU . 74.0 m-20 -60.71 -36.95 80.09 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.262 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -59.44 -33.25 71.04 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.577 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.8 m -68.8 -44.53 73.37 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.454 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 97' ' ' ASP . 12.3 mt -61.77 -45.72 92.67 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 104' ' ' VAL . 38.7 t -65.06 -33.1 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.889 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.71 -32.59 73.99 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.19 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.77 -55.06 10.89 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.823 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 101' ' ' VAL . 6.9 m -63.28 -33.89 63.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.614 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.414 HG11 ' CE2' ' A' ' 61' ' ' PHE . 42.1 t -108.82 101.46 12.59 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.496 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -104.3 -33.68 8.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.621 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -78.95 73.19 5.49 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.2 p90 -126.5 156.68 40.35 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.972 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.25 -49.07 4.84 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.277 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.13 141.15 6.73 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.022 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -135.44 149.99 49.73 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -159.9 159.84 32.85 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.707 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.403 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.7 m -89.43 153.09 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.979 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 60.8 mt -136.88 131.48 46.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.886 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -125.57 33.02 5.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.257 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -166.86 153.53 8.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.088 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.2 ptt85 -68.58 -24.61 64.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.872 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -63.57 -56.94 12.01 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.67 0.271 . . . . 0.0 110.849 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -72.17 -24.43 61.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.353 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.4 tp -74.33 -25.07 59.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.614 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -52.51 130.76 32.68 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.069 0.461 . . . . 0.0 111.069 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -51.1 -40.6 58.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.899 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.04 -41.74 98.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.897 0.38 . . . . 0.0 110.442 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -63.2 -48.72 77.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.089 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 6.9 mt -56.65 -48.07 81.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.007 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.79 -44.98 78.28 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.098 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -39.44 91.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.878 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -59.63 -53.31 59.57 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.018 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.7 pp -69.84 -24.79 63.5 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.744 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -56.54 -52.32 65.22 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 111.12 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -81.89 -38.66 24.99 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.55 48.95 19.27 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 115.69 -54.19 0.59 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.528 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 109.57 111.54 3.41 Favored Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.221 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -168.72 24.71 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -160.06 25.17 0.17 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.7 0.286 . . . . 0.0 111.329 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -59.82 -41.8 92.1 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.486 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -68.04 168.38 12.07 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.797 0.332 . . . . 0.0 110.944 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 64.04 27.59 14.22 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.595 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.47 14.34 16.64 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.898 0.38 . . . . 0.0 111.29 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 38.2 p -134.08 -54.44 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.718 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.045 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.654 0.264 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 p -117.19 123.19 46.07 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.797 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -85.25 145.97 27.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -115.76 125.55 72.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.413 ' HB3' HG11 ' A' ' 37' ' ' VAL . 7.6 t0 -81.97 109.36 16.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.555 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -69.1 -36.89 78.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.97 -47.83 60.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.67 -54.1 50.06 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.888 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.4 m -59.74 -39.0 83.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -60.1 -54.36 46.88 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.44 76.91 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.233 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -49.12 77.48 Favored 'General case' 0 C--N 1.334 -0.072 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.19 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -55.15 -46.28 75.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.49 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 66.6 m-20 -65.49 -26.91 68.13 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.437 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 tp -80.55 -38.54 29.39 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.058 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.4 t -70.33 -38.31 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.94 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 5.5 ptt180 -61.86 -28.19 69.32 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.15 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -68.86 120.83 15.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.588 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.96 27.45 3.58 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -107.84 -35.14 2.64 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.648 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.68 164.68 14.61 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.89 0.345 . . . . 0.0 111.303 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.91 58.9 3.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.0 t -133.25 119.77 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.076 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.549 HG12 ' HA ' ' A' ' 43' ' ' ALA . 30.4 pt -120.69 -40.21 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.477 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.1 p-90 -122.91 158.43 30.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.872 0.367 . . . . 0.0 111.477 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 19.4 m -140.55 143.67 28.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.935 179.145 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.41 ' O ' ' N ' ' A' ' 39' ' ' GLY . 3.2 p -102.28 97.29 7.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.994 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 6.0 m-85 -79.45 114.66 18.56 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.938 0.399 . . . . 0.0 110.611 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.16 162.17 34.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.695 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.416 ' HA ' ' O ' ' A' ' 35' ' ' THR . 38.7 p90 -111.04 121.61 45.79 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.039 0.447 . . . . 0.0 111.579 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.16 107.01 18.9 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.103 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.33 -78.71 1.42 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.278 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.4 m -151.65 33.97 0.55 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.601 0.239 . . . . 0.0 111.211 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.416 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 2.6 t -144.7 123.8 12.87 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 7.0 mt -84.88 126.08 40.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.158 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.413 HG11 ' HB3' ' A' ' 6' ' ' ASP . 5.9 m -148.6 156.91 41.88 Favored Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.519 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.431 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 37.0 Cg_endo -65.71 156.68 62.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.657 2.238 . . . . 0.0 112.295 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.41 -154.42 7.81 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.327 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.7 mp0 -27.59 132.69 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.681 0.792 . . . . 0.0 112.16 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.441 ' HG2' HG11 ' A' ' 27' ' ' VAL . 20.7 mt-30 -134.18 97.16 3.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.188 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.72 164.95 22.39 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.571 -0.823 . . . . 0.0 113.263 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.549 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.33 -17.28 24.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.743 -0.228 . . . . 0.0 111.055 179.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -92.65 129.49 38.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.673 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.488 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 23.8 t80 -77.89 -15.5 58.97 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -48.27 -41.64 28.41 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.721 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.59 -38.27 80.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.733 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -57.99 -45.78 86.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.08 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 47.7 mt -65.51 -46.18 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.995 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.97 -38.62 91.75 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.95 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 -30.93 58.79 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.73 74.57 3.39 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.808 0.337 . . . . 0.0 111.565 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -100.52 144.38 29.58 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.645 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.506 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.2 p-10 -76.05 64.96 2.0 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 111.642 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.73 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.7 t0 -168.44 44.71 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.97 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 174.66 -176.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.448 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -140.21 112.86 8.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.447 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.89 139.54 26.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.946 0.403 . . . . 0.0 111.466 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -85.69 141.53 29.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.105 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.26 113.33 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.809 0.338 . . . . 0.0 111.202 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.4 ' CB ' ' HA ' ' A' ' 78' ' ' LEU . 16.8 p90 -116.08 156.13 26.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.723 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -137.75 149.81 25.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.085 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -107.75 112.43 25.09 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.705 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -111.58 137.61 49.2 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.0 t -93.44 131.78 38.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.511 179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.3 p -134.64 116.76 15.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.624 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.487 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -148.31 142.44 10.02 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.605 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.1 79.6 1.92 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.145 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 30.91 55.97 0.22 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.426 0.631 . . . . 0.0 112.334 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.76 -46.92 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.425 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.6 m -153.9 84.61 1.15 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.935 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.487 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 2.3 ptpp? -97.67 120.08 37.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.488 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -159.56 168.07 27.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.429 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.97 139.49 37.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -118.41 141.69 48.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.608 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -100.79 138.8 37.36 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.771 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -147.32 119.82 8.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.329 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.434 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 2.3 mp -92.87 118.6 31.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.546 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.42 HD12 ' CD1' ' A' ' 125' ' ' ILE . 4.3 mt -114.92 100.02 9.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.081 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.06 120.97 24.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.403 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -98.96 130.28 45.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.194 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.7 tt -129.99 96.43 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.104 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -69.27 108.79 2.6 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.805 179.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.466 ' C ' ' H ' ' A' ' 86' ' ' VAL . 3.7 mm-40 -34.39 -38.97 0.07 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.73 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 5.6 m-80 -73.15 43.29 0.12 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.391 0.615 . . . . 0.0 111.382 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.466 ' H ' ' C ' ' A' ' 84' ' ' GLU . 8.6 p -100.94 136.02 34.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.347 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 m -66.55 155.09 38.68 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.18 42.89 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.183 -0.532 . . . . 0.0 113.061 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt -56.89 -43.66 81.51 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.631 0.253 . . . . 0.0 110.922 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.59 -39.04 92.44 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.799 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -49.21 69.57 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.099 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.49 95.12 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.947 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -57.5 -41.95 81.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.7 m -59.09 -43.95 91.88 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.842 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.7 67.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.091 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.8 m -67.6 -37.9 83.22 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.565 0.221 . . . . 0.0 110.7 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.421 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 t70 -57.77 -41.95 83.08 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -30.37 68.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.278 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 m -70.79 -42.69 70.01 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.794 0.33 . . . . 0.0 110.747 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 97' ' ' ASP . 11.2 mt -62.92 -50.93 68.89 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.06 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.452 ' HA ' HG12 ' A' ' 104' ' ' VAL . 14.3 p -59.7 -30.2 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.049 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -67.35 -39.52 85.77 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.793 0.33 . . . . 0.0 110.617 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.74 -35.01 79.18 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.994 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.452 HG12 ' HA ' ' A' ' 101' ' ' VAL . 14.8 p -87.06 -31.5 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.634 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 40.8 t -113.38 97.71 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.846 0.355 . . . . 0.0 110.894 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.45 -34.32 6.56 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.689 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.75 84.1 2.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.987 0.422 . . . . 0.0 110.83 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -138.06 164.95 27.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.806 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.95 -48.05 5.03 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -156.55 139.31 15.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.821 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 9.1 pt-20 -135.86 135.25 39.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -151.56 159.5 44.08 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.104 0.478 . . . . 0.0 111.534 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.4 t -103.94 139.72 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.373 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 47.5 mm -134.86 149.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.069 0.461 . . . . 0.0 111.489 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 8.6 t -119.05 -25.75 6.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.493 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -88.68 146.22 25.19 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.925 0.393 . . . . 0.0 110.895 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.42 ' HA ' ' CD1' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -69.37 -29.76 67.61 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.668 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.4 -32.96 43.11 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.243 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.433 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 0.5 OUTLIER -75.4 -29.28 59.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.621 -179.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.42 ' CD1' ' HA ' ' A' ' 117' ' ' ARG . 0.0 OUTLIER -95.9 -13.47 23.91 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.74 153.27 4.65 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 121.145 0.498 . . . . 0.0 111.592 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.488 ' HB2' ' CD2' ' A' ' 45' ' ' TYR . 1.8 tt0 -54.66 -37.54 65.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.895 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -42.1 93.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.84 0.353 . . . . 0.0 110.207 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.433 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 12.2 t80 -70.41 -41.8 72.49 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.0 179.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.444 HD11 ' HA ' ' A' ' 122' ' ' GLU . 23.8 mt -61.24 -57.58 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.125 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -38.2 74.47 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.415 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.9 t -70.41 -48.64 55.16 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.994 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.14 -44.88 94.29 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.653 0.263 . . . . 0.0 111.074 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -37.38 79.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.577 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.7 tttp -85.13 -59.06 2.44 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 111.639 0.236 . . . . 0.0 111.639 -179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -70.74 -52.88 17.99 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.421 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 58.91 34.26 23.54 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.55 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.502 ' HA3' ' CD2' ' A' ' 137' ' ' TYR . . . 57.77 41.48 93.97 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.815 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -91.03 73.34 1.76 Allowed Glycine 0 C--N 1.336 0.576 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.516 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 80.07 19.96 0.59 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.887 0.375 . . . . 0.0 111.206 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.86 28.44 0.22 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.765 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.502 ' CD2' ' HA3' ' A' ' 133' ' ' GLY . 1.8 t80 -51.81 -62.89 1.34 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.202 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -120.1 148.65 43.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.952 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -176.1 34.18 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.155 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -114.96 12.96 16.92 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.584 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 6.1 t -153.5 -45.57 0.09 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.836 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.843 179.657 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.628 0.251 . . . . 0.0 110.517 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -138.82 151.26 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.469 HG12 HG21 ' A' ' 104' ' ' VAL . 0.6 OUTLIER -113.22 127.85 70.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.954 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -80.44 108.91 14.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.52 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.533 ' HE3' HG13 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -65.65 -37.38 86.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.209 -179.806 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -62.76 -54.01 45.61 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.201 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.698 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.97 -51.84 66.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.163 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 m -54.45 -43.04 71.29 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.881 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -67.73 -42.43 81.9 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.799 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.96 -51.95 64.55 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.98 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.541 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -61.54 -42.35 98.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.926 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.439 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.9 t80 -56.32 -45.22 80.43 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.844 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -57.67 -42.9 84.54 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.092 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.437 HD12 HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -63.99 -44.79 91.6 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.888 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 13' ' ' ALA . 39.2 t -62.93 -33.87 63.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -60.12 -34.79 74.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 C--O 1.233 0.229 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.567 179.418 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.211 0 CA-C-O 120.955 0.407 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.437 HG11 HD12 ' A' ' 16' ' ' LEU . 39.4 t -140.76 122.9 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.683 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -126.18 -39.41 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.836 ' HB2' HG22 ' A' ' 62' ' ' VAL . 35.9 p-90 -117.44 154.88 30.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.548 HG12 ' HG2' ' A' ' 41' ' ' GLN . 16.3 m -141.73 146.68 22.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.081 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.411 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -88.17 168.59 12.63 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.221 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.45 ' HE1' HG23 ' A' ' 27' ' ' VAL . 25.9 m-85 -148.39 100.77 3.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.283 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.48 155.13 50.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.687 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.8 p90 -106.03 133.2 51.13 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.017 0.437 . . . . 0.0 111.498 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -108.8 120.3 42.08 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.193 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.34 -74.56 1.68 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.227 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.6 37.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.779 0.323 . . . . 0.0 111.227 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.1 t -154.22 131.77 11.36 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.812 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.0 mt -78.0 138.65 19.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.604 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.1 p -153.6 140.33 12.9 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.698 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 16.6 Cg_endo -57.12 161.83 10.36 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.603 2.202 . . . . 0.0 112.292 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.403 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.64 -151.26 7.23 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.632 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.0 mp0 -34.73 140.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.619 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.548 ' HG2' HG12 ' A' ' 27' ' ' VAL . 25.8 mt-30 -137.78 97.77 3.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.357 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.79 165.64 25.83 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.598 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.06 -23.14 33.29 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.643 0.258 . . . . 0.0 110.671 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -86.47 106.97 17.85 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.824 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.432 ' HD2' HD11 ' A' ' 49' ' ' ILE . 37.7 t80 -68.76 -21.08 64.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.525 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.818 ' HA ' HD12 ' A' ' 49' ' ' ILE . 14.5 tt0 -48.04 -38.38 17.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.816 0.341 . . . . 0.0 110.675 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.67 -40.62 95.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.23 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -65.52 -43.6 89.55 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.142 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.818 HD12 ' HA ' ' A' ' 46' ' ' GLN . 6.4 mt -59.72 -42.88 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.361 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.11 -37.81 69.43 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.608 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -38.94 67.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.385 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.606 ' SG ' HD11 ' A' ' 58' ' ' LEU . 5.6 m -86.69 80.4 8.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.637 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.52 161.75 13.47 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.451 ' HA ' ' CA ' ' A' ' 83' ' ' GLY . 3.1 p-10 -72.84 69.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 111.218 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.772 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.0 OUTLIER -168.07 41.17 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.427 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.721 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.97 -172.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.587 -179.335 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.549 ' HB3' HG22 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -148.5 122.77 9.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.632 0.253 . . . . 0.0 110.525 179.026 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.606 HD11 ' SG ' ' A' ' 52' ' ' CYS . 3.0 pp -153.84 174.05 15.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.048 0.451 . . . . 0.0 111.673 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.512 ' CD2' HG21 ' A' ' 101' ' ' VAL . 5.5 m-85 -107.46 171.75 7.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.691 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.3 162.33 40.89 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.425 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.413 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.9 t80 -150.15 107.17 3.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.836 HG22 ' HB2' ' A' ' 26' ' ' TRP . 11.9 t -126.18 136.18 61.58 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.028 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -109.84 136.51 49.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.605 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -121.8 144.82 48.59 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.347 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.856 0.36 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 136.93 11.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.738 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.758 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 50.4 m-85 -84.12 152.64 24.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.427 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -151.29 116.11 5.2 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.81 110.38 22.76 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.489 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.609 HG23 HD12 ' A' ' 114' ' ' ILE . 3.6 mp -104.79 126.24 59.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.329 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.9 106.9 16.64 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.35 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.422 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 64.6 t-105 -91.88 132.95 36.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.25 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.537 HG21 HG21 ' A' ' 94' ' ' THR . 5.6 pt -138.52 84.76 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.023 0.44 . . . . 0.0 111.517 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.822 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -59.12 130.93 51.52 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.974 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 86' ' ' VAL . 12.5 mt-10 -30.35 -30.91 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.772 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -75.28 36.64 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.565 0.62 . . . . 0.0 111.719 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.822 HG23 ' O ' ' A' ' 83' ' ' GLY . 98.1 t -88.61 107.46 17.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.293 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -65.26 165.3 11.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.806 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.38 -47.47 50.71 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.918 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -42.63 99.13 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.598 0.237 . . . . 0.0 110.981 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.534 ' HB3' HG13 ' A' ' 86' ' ' VAL . 2.2 mp0 -70.67 -35.1 72.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.073 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -57.08 -53.69 55.19 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.606 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.87 73.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -61.01 -36.69 80.17 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.102 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.537 HG21 HG21 ' A' ' 82' ' ' ILE . 6.6 m -55.64 -52.3 64.29 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.44 0.162 . . . . 0.0 111.006 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.63 -43.89 98.67 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.339 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.4 m -63.35 -47.41 82.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.77 0.319 . . . . 0.0 110.642 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.58 -37.47 81.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.272 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -32.23 70.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.754 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.0 m -72.35 -41.55 66.33 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.461 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.684 ' O ' HG23 ' A' ' 104' ' ' VAL . 40.7 mt -60.13 -50.19 74.67 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.512 HG21 ' CD2' ' A' ' 59' ' ' PHE . 26.4 t -64.33 -36.81 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.0 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.17 -44.82 71.82 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -38.52 70.42 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.749 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 100' ' ' LEU . 59.6 t -58.84 -45.96 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.799 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.439 HG13 ' HE2' ' A' ' 14' ' ' TYR . 39.7 t -96.21 96.18 5.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.62 -33.18 53.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.424 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -111.13 95.97 5.86 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -126.04 178.36 5.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.111 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.758 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -121.19 -54.9 1.99 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.214 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.447 ' HB2' HD23 ' A' ' 129' ' ' LEU . 7.0 mttm -151.05 132.04 14.26 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.801 0.334 . . . . 0.0 111.452 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -136.6 125.24 23.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.508 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -152.17 161.95 41.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.009 0.433 . . . . 0.0 111.436 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 22.8 t -93.35 149.25 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.617 HD13 ' HA ' ' A' ' 120' ' ' LEU . 42.7 mt -137.19 140.58 42.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.71 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 18.1 p -128.34 23.53 5.95 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.358 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.596 ' H ' HG22 ' A' ' 114' ' ' ILE . 37.0 t70 -143.77 137.58 28.17 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.7 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.529 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 6.6 ttp180 -61.74 -37.02 82.68 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.329 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -70.74 -33.64 71.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.404 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 8.6 mt-10 -76.8 -30.61 56.5 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.078 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.617 ' HA ' HD13 ' A' ' 114' ' ' ILE . 2.6 pp -88.58 -7.41 56.49 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.207 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -54.5 152.64 6.46 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.171 0.51 . . . . 0.0 110.76 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -55.45 -42.28 74.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.27 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -31.0 72.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.697 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.427 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 11.8 t80 -75.5 -46.21 33.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.97 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.472 HD11 ' O ' ' A' ' 120' ' ' LEU . 22.9 mt -58.96 -53.58 45.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -58.59 -35.27 72.14 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.5 t -60.47 -48.0 83.69 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.655 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.53 -41.72 95.03 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.93 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 77' ' ' ALA . 18.0 mt -68.39 -43.42 77.31 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 12.7 tptm . . . . . 0 C--O 1.232 0.151 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.385 -179.616 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.415 HG21 ' HG3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.711 0.291 . . . . 0.0 110.674 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -111.87 145.13 40.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.139 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 16.2 tt -110.59 127.59 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.78 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 6.5 t0 -87.31 115.62 24.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.603 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -70.77 -45.29 65.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.287 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -59.46 -42.77 92.77 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.242 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.777 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -67.03 -56.09 11.57 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.893 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.5 t -55.47 -42.92 74.99 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.877 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -44.89 93.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.863 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.16 -46.9 69.08 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.037 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.435 ' HB1' HG11 ' A' ' 27' ' ' VAL . . . -68.15 -32.35 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.309 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.418 ' HE2' HG13 ' A' ' 105' ' ' VAL . 2.2 t80 -61.03 -56.43 21.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.649 0.261 . . . . 0.0 111.473 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -68.69 -24.55 64.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.21 -39.58 22.89 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.568 0.223 . . . . 0.0 111.53 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.93 -32.94 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.419 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -67.81 -23.97 65.24 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.203 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.8 t70 . . . . . 0 C--O 1.235 0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.636 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.491 ' C ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.961 0.41 . . . . 0.0 110.507 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.545 HG13 ' HB3' ' A' ' 41' ' ' GLN . 45.8 t -137.35 112.84 10.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.637 HD12 HG13 ' A' ' 62' ' ' VAL . 1.5 pp -125.36 -31.54 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.976 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.5 ' CZ3' HG23 ' A' ' 28' ' ' THR . 34.6 p-90 -122.91 159.49 28.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.43 . . . . 0.0 111.421 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.709 HG12 ' HG2' ' A' ' 41' ' ' GLN . 6.5 m -138.08 144.86 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.176 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.5 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 1.5 p -103.75 97.06 7.13 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.558 -179.355 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 10.8 m-85 -78.62 110.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 0.0 110.948 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.439 ' HE2' ' HA3' ' A' ' 39' ' ' GLY . 1.6 pttt -126.63 175.34 8.02 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.311 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -82.13 128.27 33.97 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.6 ' HB2' HG22 ' A' ' 37' ' ' VAL . 0.8 OUTLIER -96.37 69.01 2.61 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.083 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -13.77 10.13 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.284 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 169.51 -31.9 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.956 0.378 . . . . 0.0 111.104 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -91.88 177.18 6.26 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.663 0.268 . . . . 0.0 110.854 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.07 123.01 68.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.018 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 32' ' ' ASP . 28.8 m -147.26 154.65 46.1 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.192 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.777 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.1 Cg_endo -66.27 161.37 40.83 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.519 2.146 . . . . 0.0 112.174 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.439 ' HA3' ' HE2' ' A' ' 30' ' ' LYS . . . -132.7 -151.07 6.59 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.092 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.6 mp0 -27.46 133.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.32 0.648 . . . . 0.0 111.993 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.709 ' HG2' HG12 ' A' ' 27' ' ' VAL . 35.2 mt-30 -128.74 99.05 5.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.351 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.86 23.95 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.402 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.491 ' HB2' ' C ' ' A' ' 23' ' ' ALA . . . -86.74 -25.0 24.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 110.837 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.44 118.53 30.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.508 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.525 ' CD2' HG23 ' A' ' 49' ' ' ILE . 13.1 t80 -66.83 -19.6 65.77 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.646 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.02 -40.24 10.28 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.069 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -37.19 86.54 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.272 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -70.37 -49.76 45.83 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.313 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.525 HG23 ' CD2' ' A' ' 45' ' ' TYR . 20.2 pt -59.42 -23.51 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.556 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.27 -27.44 18.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.304 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.07 -33.91 33.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.747 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.4 p -66.29 81.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.037 0.446 . . . . 0.0 111.844 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -90.82 153.16 20.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -88.24 62.17 6.59 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.997 0.427 . . . . 0.0 111.299 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.743 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.1 t0 -158.85 29.94 0.22 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.231 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.743 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.87 158.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.846 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -106.44 143.7 34.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.465 179.156 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 pp -160.04 147.37 16.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.458 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -86.04 169.57 13.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.945 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 154.86 36.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.467 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -149.71 114.52 5.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.541 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.637 HG13 HD12 ' A' ' 25' ' ' ILE . 16.5 t -124.92 144.18 35.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.152 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 143.91 45.76 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.971 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -128.56 158.16 39.22 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.001 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.586 179.315 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.578 0.228 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm -119.49 162.97 17.99 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 53.0 m-85 -132.53 131.67 41.82 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.816 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.47 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -130.24 121.05 25.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.169 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.36 100.14 10.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.257 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.755 HG21 HD12 ' A' ' 114' ' ' ILE . 12.3 mt -100.91 145.38 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.162 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.932 ' HB ' HG12 ' A' ' 113' ' ' VAL . 16.1 m -117.18 120.73 39.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.231 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.525 ' CE3' HD11 ' A' ' 120' ' ' LEU . 72.6 t-105 -92.09 143.81 26.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.329 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.534 HG23 HG11 ' A' ' 86' ' ' VAL . 56.8 mt -139.56 111.1 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.129 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -89.44 107.4 3.4 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 113.376 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 7.56 -68.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 178.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.568 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 9.5 m-80 -42.38 -26.25 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.943 0.497 . . . . 0.0 111.925 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.798 HG13 ' HB3' ' A' ' 90' ' ' GLN . 74.3 t -54.06 100.19 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.291 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.7 p -75.33 -178.41 3.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.57 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.44 -47.72 62.06 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.184 -0.531 . . . . 0.0 112.639 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.1 mt -59.02 -46.59 87.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.714 0.293 . . . . 0.0 110.621 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.798 ' HB3' HG13 ' A' ' 86' ' ' VAL . 5.8 mp0 -65.59 -38.56 89.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.521 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -63.49 -39.61 94.89 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 -34.27 77.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.071 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.415 ' HG3' HG21 ' A' ' 3' ' ' THR . 0.1 OUTLIER -59.69 -46.27 89.59 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -34.51 73.33 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.76 -51.68 54.0 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.966 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 m -64.34 -37.56 87.94 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.711 0.291 . . . . 0.0 110.665 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.732 ' HA ' HD12 ' A' ' 100' ' ' LEU . 9.1 m-20 -60.56 -40.93 93.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.69 -32.11 68.84 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.574 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.8 m -69.42 -44.13 71.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.771 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.732 HD12 ' HA ' ' A' ' 97' ' ' ASP . 7.5 mt -62.07 -46.64 88.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.855 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 97' ' ' ASP . 21.7 t -67.17 -33.36 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.165 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 ttpp -70.13 -38.39 75.53 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.955 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -30.67 69.22 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.904 HG13 HG23 ' A' ' 105' ' ' VAL . 13.9 p -92.7 -32.03 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.233 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.904 HG23 HG13 ' A' ' 104' ' ' VAL . 26.0 t -122.02 109.41 24.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.925 0.393 . . . . 0.0 110.867 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -18.53 13.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.762 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.04 79.66 2.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.764 0.316 . . . . 0.0 111.024 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.428 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.0 p90 -140.73 159.9 41.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.59 -55.17 2.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.45 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.7 150.05 51.52 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.777 0.322 . . . . 0.0 111.274 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.22 124.62 15.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.078 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.689 ' HE2' HD11 ' A' ' 114' ' ' ILE . 33.2 p90 -160.31 153.44 21.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.897 0.38 . . . . 0.0 111.366 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.932 HG12 ' HB ' ' A' ' 80' ' ' THR . 6.2 m -90.99 153.8 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.975 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.755 HD12 HG21 ' A' ' 79' ' ' ILE . 60.1 mt -139.56 142.18 33.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.928 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.21 25.87 3.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.383 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.539 ' H ' HG22 ' A' ' 114' ' ' ILE . 13.9 t70 -139.14 139.39 37.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.888 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -67.21 -36.78 82.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.999 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -66.2 -45.37 81.01 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.548 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 -25.12 64.8 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.049 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.525 HD11 ' CE3' ' A' ' 81' ' ' TRP . 5.9 mt -73.56 -31.37 63.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.981 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -49.45 136.63 16.07 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.008 0.433 . . . . 0.0 111.385 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -31.08 7.28 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.143 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -59.74 -41.84 91.83 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 120.932 0.396 . . . . 0.0 110.261 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -76.78 -43.46 36.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.111 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.619 HG22 HD13 ' A' ' 129' ' ' LEU . 38.2 mm -60.53 -47.33 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.255 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -62.56 -32.84 73.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.3 t -68.91 -47.58 65.42 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.604 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -66.16 -39.94 90.17 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.135 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.619 HD13 HG22 ' A' ' 125' ' ' ILE . 0.6 OUTLIER -61.57 -23.46 65.99 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.663 -179.937 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.1 tptm . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.612 0.244 . . . . 0.0 111.26 179.653 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.677 0.275 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -112.6 147.37 36.82 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.02 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.472 HD12 HG21 ' A' ' 36' ' ' ILE . 2.3 tt -109.42 126.98 66.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.52 107.96 13.76 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.509 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 2.2 mttt -63.03 -38.57 91.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.289 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.6 -52.44 65.41 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.143 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.746 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.14 -50.88 68.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.3 m -54.52 -43.43 71.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.117 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -61.35 -45.3 94.98 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.681 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.65 73.62 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.656 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.54 -52.01 67.01 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.963 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.43 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.9 t80 -56.23 -45.91 79.75 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.89 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -57.23 -46.22 83.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -43.35 83.99 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.062 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.656 HG23 ' O ' ' A' ' 13' ' ' ALA . 55.1 t -65.84 -33.55 64.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.984 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -59.19 -38.91 81.01 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 C--O 1.233 0.206 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.309 179.363 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.338 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.643 HG11 ' HB3' ' A' ' 41' ' ' GLN . 48.8 t -133.85 125.74 49.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-O 120.579 0.228 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.444 HD11 ' HD1' ' A' ' 26' ' ' TRP . 1.2 pp -113.07 -31.0 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.823 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.639 ' HB2' HG22 ' A' ' 62' ' ' VAL . 37.0 p-90 -127.86 157.66 39.88 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 110.968 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.699 HG12 ' HG2' ' A' ' 41' ' ' GLN . 10.2 m -140.46 144.78 26.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.723 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.421 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 98.0 m -88.28 161.42 17.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.696 0.284 . . . . 0.0 110.908 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -144.64 97.17 2.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.99 0.424 . . . . 0.0 110.518 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.86 -178.63 4.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.97 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.596 ' HB3' HD13 ' A' ' 36' ' ' ILE . 39.4 p90 -112.97 118.27 34.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.001 0.429 . . . . 0.0 111.275 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.75 111.45 23.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.192 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.7 -75.41 1.84 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.237 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.27 35.41 0.17 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 111.069 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 t -155.68 140.73 17.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.596 HD13 ' HB3' ' A' ' 31' ' ' TYR . 33.5 mm -70.61 137.35 24.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.811 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.606 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.6 p -160.27 139.87 8.2 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.996 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.746 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 12.9 Cg_endo -55.28 152.7 30.53 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.822 2.348 . . . . 0.0 112.16 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.421 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -124.62 -150.35 7.83 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.746 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 17.6 mp0 -32.05 136.25 0.07 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.651 0.781 . . . . 0.0 112.727 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.699 ' HG2' HG12 ' A' ' 27' ' ' VAL . 45.2 mt-30 -136.85 97.49 3.54 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.328 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.22 168.94 25.58 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.773 -0.727 . . . . 0.0 113.461 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.77 -20.07 23.97 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.708 0.289 . . . . 0.0 110.618 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -93.24 128.62 39.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.541 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -76.83 -21.29 55.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.787 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -38.55 19.92 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.962 0.41 . . . . 0.0 110.489 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -37.5 87.44 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.401 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.483 ' HE2' HD22 ' A' ' 120' ' ' LEU . 46.1 t80 -69.33 -48.78 60.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.22 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 52.0 mt -62.1 -38.98 82.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.357 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.99 -41.07 87.38 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.673 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -34.01 46.41 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.69 84.95 3.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.9 p -85.85 169.62 13.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.188 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -83.79 17.87 2.17 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.777 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -134.27 65.08 1.58 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.787 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 170.25 143.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.625 -179.608 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.593 ' HB3' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -112.79 125.84 54.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.631 178.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 pp -153.81 171.93 18.14 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.019 0.437 . . . . 0.0 111.503 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -104.9 167.16 9.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.54 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -153.8 155.32 35.61 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.641 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.494 ' CE1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -145.55 119.16 9.13 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.639 HG22 ' HB2' ' A' ' 26' ' ' TRP . 22.1 t -128.35 144.37 38.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.951 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 mmt85 -100.44 105.33 16.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.613 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -90.17 153.63 20.37 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.273 179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.434 ' HE2' HD23 ' A' ' 129' ' ' LEU . 9.3 mtpt -143.17 149.89 38.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.02 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -106.39 118.83 37.66 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.417 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -129.53 119.23 23.35 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.251 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.51 ' HG ' ' HB3' ' A' ' 111' ' ' GLU . 0.5 OUTLIER -99.34 124.61 44.59 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.09 179.444 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.565 HG21 ' CD1' ' A' ' 114' ' ' ILE . 1.1 mt -116.43 145.58 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.687 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -112.5 114.34 26.97 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.288 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.411 ' CD2' HD11 ' A' ' 120' ' ' LEU . 48.1 t-105 -91.99 135.67 33.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.533 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mt -138.2 89.91 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.151 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.685 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -61.09 116.83 9.92 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.975 -0.631 . . . . 0.0 111.664 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.8 mt-10 -29.21 -40.31 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.4 m-80 -72.27 41.55 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.115 0.483 . . . . 0.0 111.985 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.685 HG23 ' O ' ' A' ' 83' ' ' GLY . 20.1 t -107.71 122.76 62.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.11 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -72.4 164.45 26.33 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.85 0.357 . . . . 0.0 111.39 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.17 -44.32 57.2 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.022 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.33 -47.88 77.85 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.638 0.256 . . . . 0.0 110.896 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.453 ' CB ' HG13 ' A' ' 86' ' ' VAL . 0.7 OUTLIER -68.21 -34.97 77.24 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.49 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -60.51 -45.18 94.73 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.89 87.59 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.776 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -53.25 -40.72 64.81 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.857 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 m -56.49 -41.92 77.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.173 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.95 -45.02 97.0 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.624 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -46.35 55.16 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.514 0.197 . . . . 0.0 111.251 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.809 ' HA ' HD12 ' A' ' 100' ' ' LEU . 34.0 m-20 -64.11 -35.06 79.52 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.448 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -55.85 -36.66 67.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.877 0.37 . . . . 0.0 110.259 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.5 m -72.95 -42.15 63.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.279 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.809 HD12 ' HA ' ' A' ' 97' ' ' ASP . 9.7 mt -59.78 -48.88 79.89 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.99 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 97' ' ' ASP . 46.9 t -62.38 -46.29 96.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -36.9 76.64 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.947 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.38 -35.83 81.7 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.089 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 100' ' ' LEU . 40.4 t -76.77 -42.92 33.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.43 HG13 ' HE2' ' A' ' 14' ' ' TYR . 36.9 t -119.97 108.56 23.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.032 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.73 -25.38 12.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.586 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -78.89 85.35 4.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.834 0.35 . . . . 0.0 110.782 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -133.24 177.41 7.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.002 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.91 -57.6 2.09 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.501 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.413 ' HE3' ' HG3' ' A' ' 128' ' ' GLU . 35.2 tttm -135.88 140.35 44.05 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.219 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.51 ' HB3' ' HG ' ' A' ' 78' ' ' LEU . 9.1 pt-20 -141.28 132.36 26.26 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.873 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.583 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 11.8 p90 -154.24 168.23 27.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.968 0.413 . . . . 0.0 111.63 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 23.0 t -106.9 145.29 14.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.028 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.593 HG23 ' HB2' ' A' ' 119' ' ' GLU . 84.5 mt -124.65 134.28 67.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.594 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -122.2 17.96 10.72 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.723 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.449 ' H ' HG22 ' A' ' 114' ' ' ILE . 6.8 p-10 -155.3 145.5 21.8 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 111.022 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -61.05 -28.68 69.24 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.497 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -59.93 -46.77 88.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.612 0.244 . . . . 0.0 110.561 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.593 ' HB2' HG23 ' A' ' 114' ' ' ILE . 5.7 mt-10 -66.63 -41.83 87.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.456 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.483 HD22 ' HE2' ' A' ' 48' ' ' PHE . 12.3 mt -53.36 -35.44 60.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.586 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -42.83 126.56 3.8 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.567 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.77 -37.89 44.88 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.007 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -59.24 -46.4 88.58 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.803 0.335 . . . . 0.0 110.619 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -61.41 -50.45 72.81 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.906 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.583 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 32.6 mm -56.93 -45.76 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -48.32 74.53 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.348 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -62.87 -42.43 99.75 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.857 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.413 ' HG3' ' HE3' ' A' ' 110' ' ' LYS . 2.0 tp10 -58.0 -50.91 71.8 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.018 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -65.25 -37.74 88.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.687 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.666 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.9 p . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.554 0.216 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -119.57 149.11 42.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.097 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.567 ' HB ' HD12 ' A' ' 36' ' ' ILE . 17.1 tt -132.5 131.0 60.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.84 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.07 105.59 13.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.878 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -60.27 -41.47 93.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -62.42 -43.6 98.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.757 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -64.88 -57.34 9.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.091 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 t -54.33 -43.58 71.34 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.871 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.95 -45.18 94.81 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.713 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.68 -50.36 68.42 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 -50.78 72.68 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.627 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -55.94 -43.14 77.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.037 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.469 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 68.0 m-20 -64.55 -33.79 76.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.793 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -70.63 -46.81 62.63 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.701 0.286 . . . . 0.0 111.15 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 t -68.34 -38.69 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.449 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 9.6 ptm180 -67.52 -23.9 65.5 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.939 0.399 . . . . 0.0 111.291 -179.777 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.306 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.592 HG11 ' HB3' ' A' ' 41' ' ' GLN . 67.7 t -143.22 117.8 4.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.493 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -108.11 -29.4 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.444 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.638 ' CB ' HG22 ' A' ' 62' ' ' VAL . 42.5 p-90 -129.78 159.62 35.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.966 0.412 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -144.89 150.51 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.908 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.473 HG23 ' HE1' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -91.06 162.57 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.027 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -148.18 101.6 3.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 pttt -132.23 159.71 38.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 35' ' ' THR . 54.3 p90 -116.01 131.79 56.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.74 103.04 14.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.849 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.84 -73.27 2.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.758 . . . . 0.0 111.734 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -155.45 32.81 0.37 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.724 0.297 . . . . 0.0 111.464 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 0.7 OUTLIER -140.5 117.56 11.19 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.567 HD12 ' HB ' ' A' ' 5' ' ' ILE . 11.2 mt -77.35 133.45 30.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.245 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.546 HG23 ' HB1' ' A' ' 9' ' ' ALA . 11.3 p -151.2 137.72 11.48 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.757 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 19.5 Cg_endo -58.33 158.12 23.77 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.567 2.178 . . . . 0.0 112.639 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.441 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -127.12 -152.17 7.92 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.629 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 10.0 mp0 -35.48 140.81 0.09 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.536 0.734 . . . . 0.0 112.515 -179.175 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.592 ' HB3' HG11 ' A' ' 24' ' ' VAL . 30.1 mt-30 -139.03 98.2 3.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.518 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.56 167.56 24.74 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.26 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.493 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -85.41 -20.14 30.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.696 -0.252 . . . . 0.0 110.972 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -93.05 107.58 19.34 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.457 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.94 -21.17 65.11 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -46.34 -39.7 10.67 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.776 0.322 . . . . 0.0 110.631 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -42.55 94.94 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.409 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.705 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 40.0 t80 -68.12 -42.41 80.25 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.878 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.01 -35.13 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.207 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.36 -37.25 25.91 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.694 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.98 -42.55 57.37 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -72.66 84.17 1.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.111 0.481 . . . . 0.0 111.049 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.05 164.48 22.44 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.563 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.4 38.5 0.83 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.777 0.323 . . . . 0.0 111.793 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.757 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -139.47 45.28 1.95 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.922 0.391 . . . . 0.0 111.336 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.48 157.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.812 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.31 134.91 45.91 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.325 179.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.9 mt -147.22 170.42 17.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.063 0.459 . . . . 0.0 111.965 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -119.68 160.5 22.41 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.118 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.705 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -155.81 153.44 29.79 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.897 0.379 . . . . 0.0 111.63 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -139.38 122.62 16.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.578 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.638 HG22 ' CB ' ' A' ' 26' ' ' TRP . 11.5 t -130.53 142.38 43.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.91 0.386 . . . . 0.0 111.628 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -101.92 118.47 36.99 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.717 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -102.15 165.1 11.33 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.98 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.233 0.229 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.603 179.754 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.876 0.37 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -144.18 162.71 35.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.602 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 8.2 m-85 -106.35 153.85 21.62 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.795 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.626 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -154.65 125.94 7.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.633 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.3 tt -92.66 127.33 38.12 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.345 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.428 HD13 HD13 ' A' ' 125' ' ' ILE . 29.5 mt -122.02 107.94 20.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.603 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.413 ' HB ' HG22 ' A' ' 113' ' ' VAL . 7.2 m -97.33 132.01 43.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.007 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -114.13 141.84 46.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.871 0.367 . . . . 0.0 111.304 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.6 mt -137.27 104.11 3.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.42 124.12 6.37 Favored Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.372 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -27.61 -51.38 0.07 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.722 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 12.9 m-80 -71.41 49.07 0.15 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -178.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 86' ' ' VAL . 7.1 p -112.39 115.4 49.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.389 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.62 160.06 28.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.051 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.83 -44.45 61.09 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.708 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.25 -45.29 88.08 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.79 0.328 . . . . 0.0 110.795 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.45 -44.1 79.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.686 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -59.09 -46.22 88.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.637 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.04 88.37 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.937 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.83 -44.09 81.71 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.764 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.429 ' O ' ' HB2' ' A' ' 98' ' ' LYS . 9.5 m -50.18 -40.05 45.73 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.662 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.83 -46.85 80.16 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.793 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.97 -44.93 79.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.065 0.433 . . . . 0.0 111.114 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -62.33 -36.25 81.59 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.875 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -58.06 -34.48 70.16 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.9 m -71.0 -43.29 68.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.705 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 83.4 mt -59.57 -50.75 72.69 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.128 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.14 -31.66 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.954 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.9 -32.61 72.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.105 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -48.67 62.97 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.457 HG23 HG23 ' A' ' 105' ' ' VAL . 6.7 m -71.19 -28.67 33.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.457 HG23 HG23 ' A' ' 104' ' ' VAL . 56.1 t -101.22 102.05 12.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -99.48 -32.03 11.33 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.456 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -85.9 86.12 7.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.818 0.342 . . . . 0.0 111.343 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.468 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 p90 -140.25 158.01 44.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.702 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -100.83 -59.6 1.67 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.492 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 151.57 47.49 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.283 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -139.69 135.83 33.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.998 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -160.14 165.62 31.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.03 0.443 . . . . 0.0 111.271 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.413 HG22 ' HB ' ' A' ' 80' ' ' THR . 20.2 t -111.24 139.03 37.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.521 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.548 HG22 ' H ' ' A' ' 116' ' ' ASP . 49.2 mt -124.3 142.41 41.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.9 p -135.12 26.5 3.54 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.362 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.548 ' H ' HG22 ' A' ' 114' ' ' ILE . 34.6 t70 -138.09 138.05 38.34 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.417 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -60.5 -35.15 75.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.684 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.66 -46.9 71.08 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.535 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 1.7 mp0 -69.39 -28.95 66.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.843 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.461 ' O ' HD11 ' A' ' 125' ' ' ILE . 0.4 OUTLIER -67.01 -30.61 70.76 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.728 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -52.17 132.12 33.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.684 ' HA ' HD12 ' A' ' 125' ' ' ILE . 2.7 tp10 -52.44 -35.07 51.34 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.991 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -61.67 -38.93 89.59 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.868 0.366 . . . . 0.0 110.607 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.535 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 7.9 t80 -68.82 -51.58 39.22 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.684 HD12 ' HA ' ' A' ' 122' ' ' GLU . 5.1 mt -54.68 -40.67 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.964 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -51.26 -41.9 60.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.006 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.7 t -70.88 -42.52 69.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -56.02 -34.65 66.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.711 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.626 HD11 ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -64.99 -50.27 66.99 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.556 0.217 . . . . 0.0 111.408 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 tttm . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.283 -179.751 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.8 0.333 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -106.81 164.74 11.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.156 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.643 ' HB ' HD12 ' A' ' 36' ' ' ILE . 5.2 tt -115.26 130.38 69.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.021 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.62 101.98 8.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.472 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.36 -41.07 92.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.909 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -59.67 -51.63 68.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.948 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.621 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.12 -52.83 63.22 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.951 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.46 -39.39 73.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.153 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -44.94 96.32 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.99 67.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.25 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.474 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.41 -48.21 73.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.264 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.542 ' HE2' HG22 ' A' ' 105' ' ' VAL . 0.7 OUTLIER -56.18 -46.97 79.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.886 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -55.89 -40.84 73.58 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.468 HD21 HG21 ' A' ' 24' ' ' VAL . 15.9 tp -65.46 -44.52 86.92 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.972 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 13' ' ' ALA . 27.6 t -65.89 -35.01 74.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.779 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -61.17 -33.54 73.6 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 C--O 1.233 0.217 0 CA-C-O 121.034 0.445 . . . . 0.0 111.054 179.867 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.671 HG11 ' HB3' ' A' ' 41' ' ' GLN . 58.2 t -144.99 125.37 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-O 120.732 0.301 . . . . 0.0 110.906 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.508 HD12 HG23 ' A' ' 62' ' ' VAL . 1.3 pp -112.46 -28.57 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.749 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -131.24 155.61 46.81 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.581 HG22 ' HB3' ' A' ' 61' ' ' PHE . 34.7 m -140.85 149.51 20.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.005 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.63 175.89 6.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.85 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -151.13 93.59 1.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.404 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -102.87 176.0 5.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -89.67 144.11 26.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.111 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.511 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.5 OUTLIER -122.77 79.09 1.6 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.888 178.95 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -72.58 2.13 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.468 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.4 m -150.13 31.89 0.68 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.806 0.336 . . . . 0.0 110.766 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.0 p -146.39 176.97 9.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.033 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.643 HD12 ' HB ' ' A' ' 5' ' ' ILE . 10.9 mt -106.85 131.39 56.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.182 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.511 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 23.2 m -145.73 138.45 13.89 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.926 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.621 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 32.1 Cg_exo -58.21 168.22 3.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.468 2.112 . . . . 0.0 112.804 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.73 -153.78 7.15 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.993 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.425 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.4 mp0 -35.47 141.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.286 0.634 . . . . 0.0 112.428 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.671 ' HB3' HG11 ' A' ' 24' ' ' VAL . 23.6 mt-30 -136.84 98.12 3.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.356 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.42 168.62 25.76 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.839 -0.695 . . . . 0.0 113.209 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.415 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.88 -19.35 27.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.634 0.254 . . . . 0.0 110.86 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -89.97 111.27 22.29 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.7 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -68.0 -24.53 65.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.603 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.542 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -48.63 -36.09 15.07 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.016 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.25 -35.31 79.92 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.264 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.541 ' HE2' HD11 ' A' ' 120' ' ' LEU . 80.1 t80 -68.03 -40.6 82.86 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.561 0.22 . . . . 0.0 111.04 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.542 HD12 ' HA ' ' A' ' 46' ' ' GLN . 18.1 mt -64.31 -44.69 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.167 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -64.64 -40.8 96.09 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.768 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.39 -29.2 59.75 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.5 83.94 3.9 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.962 0.41 . . . . 0.0 111.35 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.61 173.59 8.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.577 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.2 2.8 17.03 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.686 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -126.41 77.37 1.69 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.751 0.31 . . . . 0.0 110.586 -179.659 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.684 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -170.11 -175.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.372 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.419 ' HD3' ' HG2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -169.39 74.36 0.09 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.2 pp -129.39 168.12 16.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.338 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -96.38 170.54 9.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.87 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.418 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -142.0 145.21 34.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.972 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.581 ' HB3' HG22 ' A' ' 27' ' ' VAL . 1.1 t80 -132.77 128.55 37.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 9.8 p -150.38 134.31 8.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.841 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 ttp-105 -103.91 132.38 50.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -104.3 161.65 13.88 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.919 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 65' ' ' THR . 8.9 t . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.724 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.627 0.251 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mtmt -137.56 144.31 41.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.435 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.504 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 6.4 m-85 -90.03 153.54 20.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.034 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 62' ' ' VAL . . . -140.31 114.88 9.41 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.243 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.497 HD11 HG12 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -103.33 93.22 4.86 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.638 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.641 HD13 HD13 ' A' ' 125' ' ' ILE . 5.4 mt -96.53 155.61 3.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.879 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.566 ' HB ' HG23 ' A' ' 113' ' ' VAL . 7.1 m -133.72 132.0 40.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.668 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.522 ' CE3' HD22 ' A' ' 120' ' ' LEU . 55.1 t-105 -108.71 129.38 55.36 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.853 0.359 . . . . 0.0 110.97 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 82' ' ' ILE . 2.9 tt -125.73 100.87 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.718 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.413 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -75.37 113.91 4.1 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.086 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.6 mm-40 -24.56 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.133 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.686 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.3 m-80 -71.26 44.27 0.09 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.105 0.479 . . . . 0.0 111.67 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 84' ' ' GLU . 9.0 t -77.47 142.58 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.471 179.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 162.05 29.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.029 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.17 -61.92 6.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.975 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -34.55 76.2 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.491 0.186 . . . . 0.0 111.217 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.419 ' HG2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -57.94 -33.36 68.74 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.29 179.688 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -52.91 -38.38 61.73 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.983 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.3 -37.09 23.9 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.101 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -57.59 -43.32 84.55 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.298 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.6 p -59.26 -37.6 78.02 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.267 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.92 -50.43 60.95 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.613 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.9 t -67.64 -31.54 71.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.624 0.249 . . . . 0.0 111.018 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.62 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.73 -39.17 83.79 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.243 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -57.0 -33.42 67.12 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.786 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.9 m -72.48 -44.33 62.45 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 97' ' ' ASP . 17.5 mt -59.56 -45.31 92.22 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.991 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 78' ' ' LEU . 46.1 t -65.78 -40.04 86.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 -36.6 80.68 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -45.76 78.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.739 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 29.6 t -71.87 -45.65 63.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.542 HG22 ' HE2' ' A' ' 14' ' ' TYR . 21.3 t -106.04 101.57 12.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.869 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -107.57 -32.24 7.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.443 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -81.44 71.82 8.45 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.903 0.382 . . . . 0.0 110.669 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.475 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 19.9 p90 -124.16 162.26 23.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.068 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.29 -46.52 5.78 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.66 132.0 15.58 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.067 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -133.43 127.87 34.3 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.417 ' HE2' HD11 ' A' ' 114' ' ' ILE . 14.2 p90 -160.35 162.45 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.981 0.42 . . . . 0.0 111.604 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.566 HG23 ' HB ' ' A' ' 80' ' ' THR . 11.2 p -109.07 143.02 20.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.534 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.657 HD13 ' HA ' ' A' ' 120' ' ' LEU . 4.4 mt -128.13 136.99 58.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.9 m -100.96 -31.52 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.063 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -88.6 139.09 30.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.947 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 mmm-85 -70.5 -36.45 73.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.167 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -47.86 77.57 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.674 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -70.07 -23.85 63.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.008 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.657 ' HA ' HD13 ' A' ' 114' ' ' ILE . 6.7 tp -81.61 -21.64 38.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.8 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -47.88 138.78 8.41 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.094 0.473 . . . . 0.0 111.567 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -35.44 21.52 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.049 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -38.84 75.59 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.983 0.42 . . . . 0.0 110.175 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -77.85 -42.04 34.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.641 HD13 HD13 ' A' ' 79' ' ' ILE . 49.8 mt -58.75 -50.09 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.029 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -54.8 -39.32 68.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.2 t -72.4 -44.37 62.57 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -58.12 -48.1 81.26 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.976 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.481 ' CD1' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -61.02 -31.5 71.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.101 179.665 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.957 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.643 0.259 . . . . 0.0 110.677 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -135.69 -179.9 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.006 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 tt -146.29 133.13 14.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.886 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.592 ' HB3' HG12 ' A' ' 37' ' ' VAL . 6.8 t70 -77.27 112.74 14.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.744 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.44 -45.28 76.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.058 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.81 -50.17 74.84 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.671 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -60.0 -57.0 14.74 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.305 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.628 ' HB3' HG11 ' A' ' 104' ' ' VAL . 34.2 m -58.49 -46.66 86.24 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.407 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -60.42 -49.66 76.68 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.42 -47.65 69.41 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.903 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.452 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -58.81 -35.03 72.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.452 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -66.09 -62.1 1.67 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.31 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -64.08 -32.8 74.5 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.919 0.341 . . . . 0.0 111.919 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.5 tt -61.55 -49.66 75.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.749 0.309 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.489 HG21 HG21 ' A' ' 27' ' ' VAL . 46.7 t -75.4 -32.03 24.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -4.35 41.5 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.896 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.234 0.247 0 CA-C-O 120.813 0.34 . . . . 0.0 111.14 -179.797 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.576 HG11 ' HB3' ' A' ' 41' ' ' GLN . 49.4 t -152.92 101.77 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.281 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.486 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -85.81 -27.35 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.644 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.471 ' HD1' HD11 ' A' ' 25' ' ' ILE . 21.9 p-90 -138.46 153.85 48.84 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.344 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.778 HG13 ' HG2' ' A' ' 41' ' ' GLN . 3.4 t -139.45 152.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.992 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.582 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 1.7 m -92.15 165.85 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.757 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -149.69 99.45 2.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.225 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 153.09 52.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.855 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 36' ' ' ILE . 55.1 p90 -96.07 128.77 43.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.414 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.19 109.02 21.85 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.842 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.62 -50.66 3.87 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.195 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.6 p -171.14 -33.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -83.5 132.62 34.93 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.876 0.37 . . . . 0.0 111.41 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.476 ' HA ' ' HA ' ' A' ' 31' ' ' TYR . 50.7 mt -79.5 136.07 24.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.954 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.592 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.6 m -151.03 155.94 35.19 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.671 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 43.3 Cg_endo -67.86 164.72 30.51 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.318 2.012 . . . . 0.0 112.09 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.582 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -134.38 -150.76 6.23 Favored Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.554 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.6 mp0 -31.59 136.13 0.06 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.461 0.705 . . . . 0.0 112.579 -179.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.778 ' HG2' HG13 ' A' ' 27' ' ' VAL . 8.2 mt-30 -130.69 91.37 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.228 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.66 164.18 25.18 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.26 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.486 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -88.35 -23.46 23.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.686 0.279 . . . . 0.0 110.718 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.96 115.51 22.85 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.688 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.427 ' HD2' HD11 ' A' ' 49' ' ' ILE . 30.3 t80 -67.22 -22.46 65.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.93 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -48.07 -37.2 14.59 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.663 179.512 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -38.67 91.87 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.298 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 47.0 t80 -67.91 -41.73 82.23 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.633 0.254 . . . . 0.0 111.013 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 46' ' ' GLN . 21.8 mt -63.51 -42.49 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.64 -40.5 73.05 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.642 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -34.29 68.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.623 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.5 m -76.44 82.98 3.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.961 0.41 . . . . 0.0 111.431 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.49 162.18 24.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -84.83 13.27 6.04 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.777 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -129.2 52.71 1.94 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 110.721 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 171.69 148.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.847 -179.492 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.537 ' HB3' HG23 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -111.3 129.13 56.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.73 179.554 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.43 174.47 10.6 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -115.79 167.2 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.264 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -151.82 154.01 35.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 111.415 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.506 ' CE1' HG11 ' A' ' 105' ' ' VAL . 1.7 t80 -136.21 110.07 8.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.12 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 t -115.29 122.68 69.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.723 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.41 107.72 18.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.84 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -103.59 159.17 15.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.052 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.8 t . . . . . 0 C--N 1.332 -0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.685 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.84 0.352 . . . . 0.0 111.019 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HD3' ' HG ' ' A' ' 129' ' ' LEU . 20.6 mttm -130.87 121.99 26.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.961 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -96.08 117.6 31.03 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.426 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.721 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -119.07 138.39 52.91 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.488 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 11.5 tp -117.7 100.18 7.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.559 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 39.0 mt -85.95 113.66 24.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.077 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.439 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 4.5 m -99.53 108.69 21.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.528 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -98.52 141.12 31.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.885 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.537 HG23 ' HB3' ' A' ' 57' ' ' ARG . 46.2 mt -139.9 94.1 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.261 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.693 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -62.84 109.77 2.9 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.518 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.3 mm-40 -33.78 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.662 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.6 m-80 -73.13 41.81 0.11 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.273 0.558 . . . . 0.0 111.575 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.693 HG13 ' O ' ' A' ' 83' ' ' GLY . 2.5 m -99.26 137.33 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.348 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 m -66.28 165.55 13.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.772 0.32 . . . . 0.0 111.23 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.08 -36.47 67.89 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.98 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.81 -36.12 82.86 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.553 0.216 . . . . 0.0 111.083 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -36.77 84.55 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.042 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.94 -45.27 78.84 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.782 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -35.71 74.19 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.197 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.11 -41.82 68.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.475 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -58.04 -39.26 77.99 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.136 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.23 -49.21 67.64 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.379 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -42.94 88.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.586 0.231 . . . . 0.0 110.964 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.559 ' O ' HG23 ' A' ' 101' ' ' VAL . 0.8 OUTLIER -60.39 -36.11 77.34 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.179 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -34.53 65.75 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.907 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 59.1 m -76.45 -47.79 21.85 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.903 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.401 ' O ' HG23 ' A' ' 104' ' ' VAL . 67.6 mt -60.87 -47.85 84.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.178 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 97' ' ' ASP . 45.5 t -64.59 -40.12 87.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.764 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -57.61 -44.96 85.86 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.856 179.376 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -59.7 -41.88 91.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.628 HG11 ' HB3' ' A' ' 10' ' ' CYS . 25.8 t -72.28 -37.8 59.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.409 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.506 HG11 ' CE1' ' A' ' 61' ' ' PHE . 21.6 t -125.52 104.15 12.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 120.873 0.368 . . . . 0.0 110.823 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 2.9 mt-30 -109.23 -40.38 4.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.095 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -86.62 85.5 7.3 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.059 0.457 . . . . 0.0 111.109 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -133.61 160.41 37.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.982 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.65 -51.18 29.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.03 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.8 161.7 3.87 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 6.6 pt-20 -148.08 150.04 33.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.051 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.618 ' CE1' HD11 ' A' ' 114' ' ' ILE . 12.2 p90 -157.41 160.79 38.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.152 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.439 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 10.2 p -102.32 142.59 16.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.99 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.618 HD11 ' CE1' ' A' ' 112' ' ' PHE . 3.9 mt -134.68 141.85 42.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.063 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 t -135.15 31.26 3.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.848 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.566 ' H ' HG22 ' A' ' 114' ' ' ILE . 30.4 t70 -145.12 136.55 25.18 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.705 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -59.0 -36.56 75.12 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.68 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -69.17 -44.7 71.69 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.556 0.217 . . . . 0.0 110.84 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.431 ' HB2' HG23 ' A' ' 114' ' ' ILE . 45.1 mt-10 -73.35 -31.22 63.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.159 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.405 ' N ' HG21 ' A' ' 114' ' ' ILE . 3.5 tp -74.0 -28.55 61.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.09 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -45.45 133.18 7.63 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.448 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -51.14 -32.15 22.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.1 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -56.71 -41.38 77.31 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.976 0.417 . . . . 0.0 110.29 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -70.43 -46.01 64.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.903 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.476 HG21 HD11 ' A' ' 79' ' ' ILE . 20.1 mm -61.14 -46.12 97.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.228 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -60.53 -37.87 82.58 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.619 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.62 -42.26 74.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.657 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.16 -43.13 99.36 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.093 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.721 HD11 ' HB2' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -65.73 -43.4 89.13 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.237 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 40.2 tttt . . . . . 0 CA--C 1.53 0.176 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.16 179.926 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.234 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -134.48 167.37 20.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.025 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -123.29 122.82 66.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.426 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 4.0 t70 -75.31 107.18 7.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -70.31 -36.88 74.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.777 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -66.75 -46.64 74.75 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.91 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.809 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -64.77 -51.63 61.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.302 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.2 t -55.48 -44.8 76.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -65.77 -44.01 87.15 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.77 -49.61 47.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.131 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.705 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -70.56 -36.87 73.88 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.651 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -55.35 -55.1 35.42 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.54 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.443 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 21.6 p30 -75.23 -20.97 58.95 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.3 -44.18 46.94 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.612 0.244 . . . . 0.0 111.318 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 13' ' ' ALA . 19.4 t -72.5 -40.16 62.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.513 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -59.16 -25.75 64.17 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.49 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.807 0.337 . . . . 0.0 110.797 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.989 0.423 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.2 t -129.0 108.42 17.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.033 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.463 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.2 pt -106.32 -29.89 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.651 ' HB2' HG22 ' A' ' 62' ' ' VAL . 31.0 p-90 -135.16 155.99 49.76 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.928 0.394 . . . . 0.0 111.179 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 16.7 m -141.38 149.05 20.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.225 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.533 HG22 ' H ' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -92.68 175.94 6.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.59 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.556 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 5.6 m-85 -144.82 104.73 4.04 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.007 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.98 -179.2 4.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.401 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -84.09 163.74 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.52 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.453 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -147.36 84.63 1.57 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.817 179.333 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 75.15 -68.64 2.0 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.303 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -156.68 34.88 0.31 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.8 t -158.39 158.46 34.28 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.428 HG12 ' OD2' ' A' ' 97' ' ' ASP . 3.6 mt -84.93 134.6 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.12 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.458 ' HB ' ' HD2' ' A' ' 38' ' ' PRO . 30.7 m -147.54 157.36 44.85 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.009 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.809 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.9 Cg_endo -65.88 171.37 9.99 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.335 2.023 . . . . 0.0 112.146 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.498 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -135.91 -151.91 6.25 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.53 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.531 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.35 140.27 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.418 0.687 . . . . 0.0 112.248 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -135.33 100.94 4.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.184 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.52 161.5 24.48 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.128 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.463 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.56 -26.75 34.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 0.0 110.52 179.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -96.04 122.42 38.85 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.533 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -68.2 -18.09 64.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.905 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.719 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -47.58 -40.12 18.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.623 0.249 . . . . 0.0 110.973 179.634 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.19 -39.66 91.03 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.226 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 39.8 t80 -66.43 -47.6 72.67 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.893 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.719 HD12 ' HA ' ' A' ' 46' ' ' GLN . 4.9 mt -58.18 -38.5 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.714 0.292 . . . . 0.0 110.781 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.41 -36.38 83.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.574 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.06 -23.44 22.55 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.599 ' SG ' HD22 ' A' ' 120' ' ' LEU . 0.4 OUTLIER -73.46 81.97 1.45 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.212 -179.796 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.2 p -109.48 146.13 35.09 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.638 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.583 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.7 m-20 -80.07 70.14 6.61 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.01 0.433 . . . . 0.0 111.385 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.706 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.9 t70 -165.5 45.08 0.08 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.204 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.765 HG13 ' N ' ' A' ' 57' ' ' ARG . 2.9 p 178.29 -147.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.765 ' N ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -163.71 123.41 2.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.392 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.1 pp -158.85 156.8 30.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.878 0.371 . . . . 0.0 111.322 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.556 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 67.3 m-85 -99.69 172.21 7.41 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.554 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -150.22 156.22 41.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -147.24 122.11 9.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.68 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.651 HG22 ' HB2' ' A' ' 26' ' ' TRP . 14.8 t -130.98 143.05 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-O 120.888 0.375 . . . . 0.0 111.507 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.478 ' HD2' HG12 ' A' ' 17' ' ' VAL . 60.7 mtt85 -121.71 112.67 18.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.551 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.598 ' HD2' HD22 ' A' ' 129' ' ' LEU . 16.2 m-85 -95.45 165.52 12.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.269 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.777 179.805 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.839 0.352 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.534 ' HG2' HD23 ' A' ' 129' ' ' LEU . 2.2 tptt -130.25 162.04 29.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.932 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.428 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 14.7 m-85 -130.37 146.92 52.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.617 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.593 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -146.76 111.51 5.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.494 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 14.8 tp -103.48 86.74 2.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.895 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.725 HG21 HD12 ' A' ' 114' ' ' ILE . 2.2 mp -96.26 141.4 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.249 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.7 m -114.35 124.18 51.34 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.431 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.52 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 68.7 t-105 -94.18 133.55 37.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.834 0.349 . . . . 0.0 110.745 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.512 HG23 ' O ' ' A' ' 82' ' ' ILE . 3.0 tt -128.33 90.82 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.837 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.583 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.56 111.33 4.06 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.709 -0.757 . . . . 0.0 111.692 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -37.07 -45.84 0.63 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -178.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.706 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.1 m-80 -73.68 46.54 0.22 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 90' ' ' GLN . 12.4 p -104.89 134.59 45.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.25 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 p -63.17 153.87 33.02 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.938 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.36 58.58 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 113.2 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -43.25 92.22 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.797 0.299 . . . . 0.0 111.073 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.469 ' HB2' HG22 ' A' ' 86' ' ' VAL . 31.5 mm-40 -67.68 -33.78 75.61 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.997 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.408 ' O ' HG22 ' A' ' 94' ' ' THR . 0.0 OUTLIER -57.4 -34.63 69.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.951 179.446 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.56 -33.93 27.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.949 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.5 tptt -56.13 -44.07 78.82 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.477 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.408 HG22 ' O ' ' A' ' 91' ' ' ARG . 8.6 t -61.35 -34.16 74.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.727 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.54 -48.88 82.16 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.06 -0.59 . . . . 0.0 112.103 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -38.44 86.35 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.568 0.223 . . . . 0.0 110.718 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.53 ' HA ' HD12 ' A' ' 100' ' ' LEU . 4.5 m-20 -60.98 -44.88 96.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.099 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.4 ttpt -58.79 -29.9 67.18 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.8 m -71.99 -45.37 61.23 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.448 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 97' ' ' ASP . 6.2 mt -62.33 -47.65 83.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.098 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.414 ' HA ' HG12 ' A' ' 104' ' ' VAL . 12.5 p -66.2 -32.77 59.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -68.46 -38.18 80.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.763 0.316 . . . . 0.0 110.837 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -47.22 68.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.784 HG13 HG23 ' A' ' 105' ' ' VAL . 14.8 p -71.04 -33.13 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.642 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.784 HG23 HG13 ' A' ' 104' ' ' VAL . 21.9 t -109.17 91.87 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.939 0.399 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -98.83 -35.96 9.95 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.046 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -79.43 79.78 5.86 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 110.829 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -127.84 -179.78 5.13 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -114.11 -50.98 2.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.344 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -145.16 150.96 37.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 7.7 pt-20 -151.99 128.39 10.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.573 ' HE2' HD11 ' A' ' 114' ' ' ILE . 16.4 p90 -159.78 159.43 32.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.341 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.73 146.1 7.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.727 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.725 HD12 HG21 ' A' ' 79' ' ' ILE . 58.7 mt -132.85 144.71 35.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.11 31.26 2.43 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.078 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.532 ' H ' HG22 ' A' ' 114' ' ' ILE . 38.6 t70 -147.07 140.54 25.54 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.916 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.501 ' HA ' HD21 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -60.9 -34.96 75.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.462 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.1 tttm -75.3 -37.85 60.62 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.73 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.48 ' CB ' HG23 ' A' ' 114' ' ' ILE . 30.7 mt-10 -67.2 -45.09 77.91 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.825 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.599 HD22 ' SG ' ' A' ' 52' ' ' CYS . 4.5 pp -72.02 -22.15 61.45 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.343 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -48.27 133.57 15.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.769 0.319 . . . . 0.0 110.874 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -49.15 -34.09 13.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.058 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -60.09 -46.29 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.894 0.378 . . . . 0.0 110.285 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -68.51 -44.23 75.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.107 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.412 HG22 HD13 ' A' ' 129' ' ' LEU . 37.5 mm -59.85 -45.24 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.13 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -57.34 -39.85 76.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.105 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.7 t -71.52 -46.19 60.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.727 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -57.08 -39.84 75.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.598 HD22 ' HD2' ' A' ' 64' ' ' PHE . 1.9 mp -72.51 -37.75 68.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.522 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 45.5 tptt . . . . . 0 C--O 1.232 0.175 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.5 -179.609 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -104.86 162.28 13.46 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.09 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -118.73 135.45 59.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.07 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.32 115.02 22.83 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.4 -41.64 93.44 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.078 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.32 -44.78 78.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.147 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.672 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -60.24 -59.57 5.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.238 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.8 m -55.73 -43.68 76.82 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.384 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -65.02 -41.66 95.08 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.484 ' HA ' ' ND2' ' A' ' 15' ' ' ASN . . . -55.18 -55.53 30.21 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.845 0.355 . . . . 0.0 110.733 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.504 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -59.59 -38.49 81.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.674 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -57.68 -50.53 72.88 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.484 ' ND2' ' HA ' ' A' ' 12' ' ' ALA . 13.0 p30 -62.13 -29.49 70.37 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.84 -45.36 15.65 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.691 0.281 . . . . 0.0 111.34 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.689 HG11 HG11 ' A' ' 27' ' ' VAL . 27.1 m -64.82 -29.75 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.698 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -56.62 -40.07 74.73 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.177 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.5 t70 . . . . . 0 C--O 1.233 0.185 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.604 179.631 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 41' ' ' GLN . 60.3 t -139.13 114.54 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.74 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.483 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.3 pt -110.97 -27.56 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 40.8 p-90 -128.19 161.82 28.41 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.883 0.373 . . . . 0.0 111.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.689 HG11 HG11 ' A' ' 17' ' ' VAL . 0.8 OUTLIER -144.07 151.87 16.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.521 179.178 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.455 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 64.0 m -93.21 161.08 14.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.692 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -146.12 99.24 3.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.997 0.427 . . . . 0.0 110.274 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.23 -179.57 5.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.703 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.925 ' HB3' HD13 ' A' ' 36' ' ' ILE . 52.2 p90 -131.54 132.94 44.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.204 0.526 . . . . 0.0 111.547 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -104.03 114.0 27.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.238 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.67 -74.35 1.78 Allowed Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.998 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 m -162.09 33.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.542 0.21 . . . . 0.0 111.515 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.4 p -140.7 134.58 30.55 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.851 0.357 . . . . 0.0 111.039 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.925 HD13 ' HB3' ' A' ' 31' ' ' TYR . 39.9 mm -81.69 130.9 35.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.814 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.448 HG12 ' CB ' ' A' ' 9' ' ' ALA . 16.7 m -152.62 142.59 15.01 Favored Pre-proline 0 C--O 1.233 0.212 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.213 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.672 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 38.2 Cg_exo -60.24 165.7 10.4 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.504 2.136 . . . . 0.0 112.276 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.455 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -134.95 -149.05 5.8 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.449 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.449 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.1 mp0 -34.88 136.48 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.388 0.675 . . . . 0.0 112.514 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.411 ' HB3' HG11 ' A' ' 24' ' ' VAL . 14.2 mt-30 -137.32 98.87 3.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.281 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.68 165.85 27.09 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.415 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.483 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.32 -22.04 33.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.679 -0.26 . . . . 0.0 110.79 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -88.45 109.44 20.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.537 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -66.86 -21.12 66.02 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.4 -39.2 21.67 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.767 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.51 -36.97 84.25 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.3 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 45.9 t80 -70.11 -42.08 73.13 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.903 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 63.3 mt -60.51 -40.41 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.753 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -70.8 -36.15 72.86 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.438 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -34.34 58.59 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.695 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.29 82.96 1.38 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 111.656 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.16 155.9 25.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.067 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.77 11.27 6.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.757 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -128.25 53.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.833 0.349 . . . . 0.0 110.912 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.48 153.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.143 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.72 ' HB3' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -111.18 143.1 42.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.738 179.289 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -160.55 177.22 10.74 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.785 0.326 . . . . 0.0 111.591 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -116.49 158.73 23.13 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.937 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -147.99 164.27 34.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.985 0.421 . . . . 0.0 111.614 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.437 ' CE2' HG11 ' A' ' 105' ' ' VAL . 2.4 t80 -150.81 121.48 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.242 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 39.7 t -124.96 134.34 67.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.601 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -93.08 113.8 26.15 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.217 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.4 143.22 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.373 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 65' ' ' THR . 5.6 t . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.497 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.596 0.236 . . . . 0.0 110.677 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -144.79 157.07 44.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.874 0.369 . . . . 0.0 111.366 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 15.5 m-85 -110.78 137.81 47.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.591 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.74 128.54 37.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.27 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 79' ' ' ILE . 1.4 tt -89.78 132.19 35.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.443 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 125' ' ' ILE . 14.8 mt -123.92 125.02 70.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.496 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.745 ' HB ' HG12 ' A' ' 113' ' ' VAL . 8.9 m -106.54 119.82 40.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.093 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.62 ' CE3' HD12 ' A' ' 120' ' ' LEU . 37.6 t-105 -98.52 137.4 37.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 111.498 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.511 HG23 HG11 ' A' ' 86' ' ' VAL . 53.3 mt -137.4 87.27 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.932 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.5 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -63.2 106.46 1.33 Allowed Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.785 -0.643 . . . . 0.0 113.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 1.02 -65.22 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 10.8 m120 -45.94 -21.66 0.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.72 HG21 ' HB3' ' A' ' 57' ' ' ARG . 53.5 t -54.53 107.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.615 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 m -74.3 173.07 10.73 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.33 -43.15 57.37 Favored Glycine 0 C--N 1.336 0.567 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.061 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.58 -46.99 73.83 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.713 0.292 . . . . 0.0 110.808 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.693 ' HB3' HG13 ' A' ' 86' ' ' VAL . 9.3 mp0 -68.24 -37.67 81.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.358 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.428 ' O ' HG22 ' A' ' 94' ' ' THR . 7.6 mmt180 -58.03 -35.87 71.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 -38.91 71.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.93 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -59.72 -49.05 79.23 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.164 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.486 ' HB ' ' HD2' ' A' ' 57' ' ' ARG . 9.2 t -61.04 -33.38 73.21 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.23 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.72 93.65 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.963 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.18 -38.72 66.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.56 0.219 . . . . 0.0 110.498 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -58.19 -41.4 83.87 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.344 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -55.79 -33.68 64.6 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.745 0.307 . . . . 0.0 110.648 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.2 m -70.52 -44.43 67.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.426 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 61.9 mt -58.38 -49.35 77.56 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.674 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.1 t -64.98 -38.85 83.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.022 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 ttmt -60.95 -44.34 97.41 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.145 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -58.42 -45.34 88.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.69 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 t -74.89 -41.05 46.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.674 HG13 ' HE2' ' A' ' 14' ' ' TYR . 38.8 t -104.53 74.48 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 121.067 0.461 . . . . 0.0 110.754 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -77.62 -26.37 50.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.418 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.98 83.57 5.86 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.843 0.354 . . . . 0.0 110.73 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -132.42 158.43 42.02 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -110.51 -48.93 3.1 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.341 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.55 116.7 7.88 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.026 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -122.32 131.21 53.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.964 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -158.01 154.95 28.52 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.028 0.442 . . . . 0.0 111.51 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.745 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.3 m -89.68 156.28 3.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.357 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.57 HG22 ' H ' ' A' ' 116' ' ' ASP . 57.8 mt -138.51 140.6 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.955 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -124.25 13.35 8.93 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.78 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.57 ' H ' HG22 ' A' ' 114' ' ' ILE . 8.7 p-10 -148.44 144.28 27.32 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.942 0.401 . . . . 0.0 110.871 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -60.27 -29.71 68.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.989 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -46.75 88.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.731 0.301 . . . . 0.0 110.855 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.422 ' CB ' HG23 ' A' ' 114' ' ' ILE . 1.0 OUTLIER -74.26 -25.81 59.84 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.621 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.62 HD12 ' CE3' ' A' ' 81' ' ' TRP . 0.4 OUTLIER -83.41 -22.77 32.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.675 0.274 . . . . 0.0 111.045 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.431 ' HG2' ' OD1' ' A' ' 123' ' ' ASN . 12.5 tt0 -54.48 133.13 45.81 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.76 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -49.15 -45.08 43.29 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.177 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.431 ' OD1' ' HG2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -58.48 -32.79 69.1 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.25 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.414 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 20.6 t80 -74.81 -51.01 15.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.824 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 79' ' ' ILE . 21.6 mt -59.0 -48.18 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.071 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -55.0 -38.6 68.06 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.9 t -66.09 -49.11 68.69 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.04 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -60.26 -50.27 74.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.91 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.09 -37.19 84.12 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.4 tttp . . . . . 0 N--CA 1.464 0.229 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.612 -179.576 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.796 0.331 . . . . 0.0 110.743 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -100.25 147.21 26.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.516 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.447 ' HB ' HD13 ' A' ' 100' ' ' LEU . 2.9 tt -124.68 131.05 73.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -89.08 108.11 19.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.565 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -67.9 -34.05 75.89 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.153 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -54.89 40.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.218 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -67.97 -46.28 71.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.339 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 m -58.32 -45.09 88.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.302 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -68.77 -45.08 72.31 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.52 -46.66 73.56 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.781 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.569 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -62.07 -47.62 83.84 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -56.2 -43.32 78.37 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.143 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -59.44 -46.17 89.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.4 HD22 ' OE1' ' A' ' 41' ' ' GLN . 1.4 tt -65.31 -43.75 90.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.826 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 13' ' ' ALA . 47.6 t -66.72 -31.18 52.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.729 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -37.71 70.57 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.699 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.234 0.256 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.703 179.539 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.45 ' O ' HG23 ' A' ' 25' ' ' ILE . . . . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.5 t -54.77 118.54 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.604 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 43' ' ' ALA . 31.7 pt -113.78 -36.29 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.718 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.688 ' CB ' HG22 ' A' ' 62' ' ' VAL . 37.3 p-90 -136.21 157.61 46.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.037 0.446 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.422 ' CG2' HG21 ' A' ' 17' ' ' VAL . 4.6 m -138.64 144.74 29.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.473 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.447 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 97.5 m -84.9 162.53 19.43 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.553 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.53 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 6.9 m-85 -144.75 96.41 2.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.127 0.489 . . . . 0.0 110.21 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.436 ' HB3' HD22 ' A' ' 58' ' ' LEU . 1.5 pttt -125.86 179.93 4.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.681 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.733 ' HB3' HD13 ' A' ' 36' ' ' ILE . 51.1 p90 -109.4 125.4 52.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.926 0.393 . . . . 0.0 111.301 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.84 101.04 12.83 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.02 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.12 -68.89 2.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.887 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.7 p -160.17 33.08 0.17 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.633 0.254 . . . . 0.0 111.231 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -149.91 131.06 14.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.733 HD13 ' HB3' ' A' ' 31' ' ' TYR . 37.6 mm -71.31 129.68 35.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.986 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.463 HG12 ' HB3' ' A' ' 9' ' ' ALA . 4.0 m -152.22 157.43 33.95 Favored Pre-proline 0 C--O 1.234 0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.111 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 29.4 Cg_endo -62.46 162.59 23.57 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.653 2.236 . . . . 0.0 112.499 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.447 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -138.22 -146.93 5.11 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.706 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.507 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 1.9 mp0 -30.3 133.88 0.06 Allowed 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.499 0.719 . . . . 0.0 112.895 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.4 ' OE1' HD22 ' A' ' 16' ' ' LEU . 2.8 tt0 -131.42 101.14 5.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.001 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.03 165.32 25.16 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.503 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.479 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.37 -12.13 33.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.254 0.222 . . . . 0.0 111.464 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -116.08 134.04 55.37 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.668 0.271 . . . . 0.0 110.542 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -69.96 -19.16 63.37 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.894 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -49.81 -40.12 40.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.651 0.262 . . . . 0.0 110.84 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -36.16 79.22 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.403 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' ALA . 42.2 t80 -64.78 -61.12 2.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 121.289 -0.164 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 40.6 mt -57.59 -30.77 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.159 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -47.0 85.8 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.905 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -99.57 -0.16 41.03 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -88.45 88.83 7.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.036 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.1 156.86 17.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.921 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.505 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.1 p-10 -80.48 62.44 4.58 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.512 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.775 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.2 t0 -161.62 43.45 0.15 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.314 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.775 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.86 153.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.722 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.7 127.3 52.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.327 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' A' ' 30' ' ' LYS . 13.4 mt -142.58 156.38 45.09 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.924 0.392 . . . . 0.0 111.671 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.53 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 78.9 m-85 -104.29 161.22 14.23 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.186 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.438 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -154.15 146.47 23.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.879 0.371 . . . . 0.0 111.505 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -128.56 110.7 12.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.523 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.688 HG22 ' CB ' ' A' ' 26' ' ' TRP . 18.2 t -125.93 131.13 72.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.889 0.376 . . . . 0.0 111.361 -179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.9 mtm-85 -88.3 151.48 22.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.692 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -127.83 158.98 36.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.2 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.732 179.716 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.751 0.31 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -143.3 157.0 44.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.62 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 6.4 m-85 -107.49 147.74 30.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.71 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.457 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -147.7 115.81 6.52 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.445 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 5.6 tt -94.21 106.48 18.45 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.179 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.595 HG23 HD12 ' A' ' 114' ' ' ILE . 29.0 mm -94.67 120.95 44.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.285 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.481 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.1 OUTLIER -106.95 123.81 48.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.252 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.602 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 40.9 t-105 -105.85 136.01 46.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.04 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.464 HG22 HG21 ' A' ' 86' ' ' VAL . 36.7 mt -137.6 93.36 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.505 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -64.38 112.28 4.86 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.573 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.407 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.6 mt-10 -24.72 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.719 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.3 m-80 -72.16 43.23 0.1 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.577 HG13 ' HB3' ' A' ' 90' ' ' GLN . 11.6 t -75.77 126.87 36.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.596 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.5 p -73.11 163.74 27.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.991 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.08 -38.77 39.96 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 121.215 -0.517 . . . . 0.0 113.084 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.6 mp -81.6 -40.52 22.88 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.577 ' HB3' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -58.01 -37.32 74.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.458 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -41.39 89.11 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.628 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.27 -38.54 78.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.753 179.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -52.87 -41.45 64.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.21 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 m -52.51 -46.78 66.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.376 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.7 -47.71 74.02 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.917 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -45.51 90.61 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.989 0.395 . . . . 0.0 111.008 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.448 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 78.6 m-20 -64.69 -39.21 93.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.318 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -57.27 -33.6 67.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.767 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.1 m -71.33 -48.7 48.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.557 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.687 ' O ' HG23 ' A' ' 104' ' ' VAL . 52.6 mt -56.04 -51.69 66.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 97' ' ' ASP . 44.1 t -60.81 -39.55 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.143 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -55.0 -41.92 71.86 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.999 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.84 -34.08 66.56 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.228 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 100' ' ' LEU . 33.8 t -67.64 -47.08 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.531 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 26.4 t -106.89 114.98 47.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -107.24 -29.08 9.53 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.283 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -93.83 88.0 5.61 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.737 0.303 . . . . 0.0 111.03 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -141.61 168.75 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -101.38 -53.87 2.9 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.456 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -150.34 147.44 27.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.605 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 5.2 pt-20 -142.88 120.12 11.52 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.61 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -145.84 148.47 32.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.874 0.368 . . . . 0.0 111.262 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.481 HG12 ' HB ' ' A' ' 80' ' ' THR . 6.1 m -81.31 160.59 3.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.474 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.714 HD13 ' HA ' ' A' ' 120' ' ' LEU . 77.3 mt -141.09 132.86 28.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.103 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 m -116.61 -17.65 10.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.846 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.47 151.99 32.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.891 0.377 . . . . 0.0 111.176 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.492 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 32.1 ttp180 -64.2 -26.41 68.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.615 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 6.9 tptp -68.31 -38.06 81.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.993 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.67 ' CB ' HG23 ' A' ' 114' ' ' ILE . 1.2 mt-10 -73.4 -39.31 65.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.646 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.714 ' HA ' HD13 ' A' ' 114' ' ' ILE . 4.2 pp -74.77 -15.97 60.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.251 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -51.46 130.15 26.87 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.986 0.422 . . . . 0.0 110.697 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -48.05 -44.74 31.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.714 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -62.8 -41.31 99.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.939 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 32.9 t80 -59.47 -52.24 66.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.22 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.526 HG21 HD11 ' A' ' 79' ' ' ILE . 11.5 mt -55.21 -42.9 68.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -57.29 -40.99 78.92 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 32.6 t -69.27 -41.96 76.17 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.71 88.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.253 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.457 HD21 ' HB2' ' A' ' 77' ' ' ALA . 4.7 mp -71.05 -33.03 69.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.53 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 37.4 tttt . . . . . 0 C--O 1.233 0.197 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.326 -179.632 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.617 HG23 ' HE2' ' A' ' 93' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.831 0.348 . . . . 0.0 111.068 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -136.52 145.04 44.62 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.531 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.526 HD12 HD11 ' A' ' 36' ' ' ILE . 13.9 tt -112.72 128.67 69.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 6.1 t0 -75.69 102.49 5.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.556 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -34.59 74.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.009 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -69.6 -50.12 47.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.898 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.517 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -62.46 -54.26 42.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.3 t -56.02 -37.09 68.71 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.813 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -60.04 -52.61 64.62 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.59 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -52.85 -48.77 66.82 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.126 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.545 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -58.27 -36.42 73.23 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.59 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.542 ' CE2' HG13 ' A' ' 105' ' ' VAL . 0.4 OUTLIER -60.86 -62.08 2.12 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.267 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -62.55 -33.44 74.94 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -60.94 -48.39 82.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.675 0.274 . . . . 0.0 110.819 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 13' ' ' ALA . 49.0 t -72.58 -30.66 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.46 -36.71 64.4 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.987 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 t70 . . . . . 0 C--O 1.232 0.174 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.58 179.6 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.272 0 CA-C-O 121.054 0.454 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.3 t -141.48 104.46 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.0 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.439 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -108.62 -26.37 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.563 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.424 ' HD1' HD11 ' A' ' 25' ' ' ILE . 26.8 p-90 -135.65 157.9 45.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.859 0.361 . . . . 0.0 111.333 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.572 HG22 ' HB3' ' A' ' 61' ' ' PHE . 27.0 m -140.99 150.06 20.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.268 179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.418 HG22 ' H ' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -97.47 174.71 6.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.967 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.418 ' H ' HG22 ' A' ' 28' ' ' THR . 2.3 m-85 -149.39 96.02 2.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.187 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.06 175.23 5.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.419 -179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.578 ' CE1' HG23 ' A' ' 36' ' ' ILE . 0.8 OUTLIER -104.18 120.7 41.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.912 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -102.54 89.82 3.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.201 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.63 -79.62 1.38 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.146 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.25 32.06 1.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.786 0.327 . . . . 0.0 111.21 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.6 t -154.36 148.87 26.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.663 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.578 HG23 ' CE1' ' A' ' 31' ' ' TYR . 5.7 pt -90.04 135.36 26.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.952 0.406 . . . . 0.0 111.232 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.502 HG13 ' CB ' ' A' ' 9' ' ' ALA . 44.6 t -141.98 139.35 18.01 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.602 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.517 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 9.9 Cg_endo -51.07 153.16 9.48 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.61 2.207 . . . . 0.0 112.248 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -126.17 -152.96 8.25 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.653 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.0 mp0 -34.05 139.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.562 0.745 . . . . 0.0 112.682 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' HG2' HG12 ' A' ' 27' ' ' VAL . 11.7 mt-30 -134.42 94.64 3.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.217 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.08 165.58 21.79 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.782 -0.723 . . . . 0.0 113.301 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.439 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -90.59 -19.94 23.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.587 0.232 . . . . 0.0 110.962 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.72 126.24 38.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.766 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.462 ' HD2' HD11 ' A' ' 49' ' ' ILE . 42.5 t80 -74.03 -16.64 61.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.889 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -51.33 -41.01 60.27 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.657 0.265 . . . . 0.0 111.043 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.01 -29.48 67.66 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.239 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.609 ' HE2' ' HB1' ' A' ' 60' ' ' ALA . 32.4 t80 -63.37 -45.36 91.53 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.716 0.293 . . . . 0.0 110.825 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.462 HD11 ' HD2' ' A' ' 45' ' ' TYR . 3.5 mt -69.13 -42.96 81.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.093 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -55.39 -47.08 76.4 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.483 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -75.94 -33.77 59.84 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.479 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -72.83 81.05 1.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.849 0.357 . . . . 0.0 111.332 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.3 p -107.45 144.92 33.7 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.565 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.05 65.85 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.347 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.799 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -157.83 38.86 0.27 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.417 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.799 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 161.95 163.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.252 0.621 . . . . 0.0 110.365 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.726 ' HB3' HG11 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -107.98 124.65 50.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.47 179.057 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 pp -147.94 145.28 28.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.089 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 97' ' ' ASP . 3.4 m-85 -90.59 166.59 13.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.609 ' HB1' ' HE2' ' A' ' 48' ' ' PHE . . . -153.78 172.33 17.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.134 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.572 ' HB3' HG22 ' A' ' 27' ' ' VAL . 1.5 t80 -152.31 138.47 18.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.2 t -143.52 137.65 25.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.003 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -102.86 127.64 49.97 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.662 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -117.04 159.19 22.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.902 0.382 . . . . 0.0 111.332 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.711 179.526 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.644 0.259 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -141.19 129.14 21.88 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.552 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 70.3 m-85 -85.3 141.1 30.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.66 114.13 17.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.732 HD11 HG11 ' A' ' 101' ' ' VAL . 0.5 OUTLIER -94.96 106.46 18.45 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.542 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.444 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 25.6 mm -103.15 115.22 44.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.438 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.459 HG21 HG22 ' A' ' 113' ' ' VAL . 5.2 t -109.16 110.66 21.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.324 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -86.5 140.08 30.27 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.509 HG23 ' HB3' ' A' ' 115' ' ' SER . 2.7 tt -128.16 84.57 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.352 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.508 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -67.62 116.95 8.3 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.889 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.0 mm-40 -33.54 -31.68 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.751 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.5 m-80 -73.58 36.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.454 0.57 . . . . 0.0 111.727 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.726 HG11 ' HB3' ' A' ' 57' ' ' ARG . 3.7 m -102.04 113.32 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 70.9 m -65.52 174.28 2.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.952 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -49.18 -45.99 34.37 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.933 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -47.81 80.58 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.674 0.273 . . . . 0.0 110.982 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -63.2 -37.72 88.33 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.106 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -50.66 71.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.775 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.96 72.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.542 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.617 ' HE2' HG23 ' A' ' 3' ' ' THR . 0.3 OUTLIER -56.57 -36.87 69.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.248 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.3 -47.5 85.17 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.832 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.85 -46.55 93.89 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.016 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.649 ' O ' HG22 ' A' ' 99' ' ' THR . 4.0 m -63.81 -33.12 74.96 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.784 0.326 . . . . 0.0 110.722 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.553 ' O ' HG23 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -69.78 -31.18 68.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -34.29 74.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.678 0.275 . . . . 0.0 110.897 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.649 HG22 ' O ' ' A' ' 96' ' ' THR . 7.4 t -83.68 -33.24 25.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.276 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 97' ' ' ASP . 21.1 mt -68.08 -47.76 67.38 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.809 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.732 HG11 HD11 ' A' ' 78' ' ' LEU . 37.9 t -68.74 -38.02 78.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.366 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -63.23 -39.46 94.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.704 0.287 . . . . 0.0 110.656 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -65.35 -50.61 64.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.971 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.868 HG13 HG23 ' A' ' 105' ' ' VAL . 14.9 p -71.22 -36.26 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.337 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.868 HG23 HG13 ' A' ' 104' ' ' VAL . 26.1 t -118.15 98.94 7.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.937 0.399 . . . . 0.0 110.837 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -100.95 -36.84 8.89 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.008 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -78.15 81.22 4.54 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 110.74 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -130.18 177.07 7.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.698 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -110.07 -52.58 2.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.112 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -154.95 143.77 20.78 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.894 0.378 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.528 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 13.4 pt-20 -148.06 126.53 12.39 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.529 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -143.79 168.01 20.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.39 . . . . 0.0 111.434 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.459 HG22 HG21 ' A' ' 80' ' ' THR . 4.7 t -107.09 130.08 59.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.466 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.632 HG22 ' H ' ' A' ' 116' ' ' ASP . 41.4 mm -127.51 148.27 32.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.132 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.509 ' HB3' HG23 ' A' ' 82' ' ' ILE . 47.7 p -138.14 30.94 2.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.992 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.632 ' H ' HG22 ' A' ' 114' ' ' ILE . 26.2 t70 -136.29 135.01 38.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.682 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.11 85.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.373 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -63.04 -47.68 81.99 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.479 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -69.71 -30.14 67.71 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.853 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -33.12 74.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.765 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -47.46 131.76 13.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.206 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -51.73 -32.63 31.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.884 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -58.19 -45.18 88.01 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.374 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -67.28 -47.34 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.012 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.87 -47.95 89.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -62.18 -41.76 98.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -45.44 93.26 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.727 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.45 -49.78 72.32 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -37.1 82.5 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.099 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 tttm . . . . . 0 C--O 1.232 0.179 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.948 179.632 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.834 0.35 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.445 ' O ' HD12 ' A' ' 36' ' ' ILE . 21.3 mttm -104.08 176.79 5.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.514 HD13 ' HA ' ' A' ' 101' ' ' VAL . 10.0 tt -118.16 123.84 72.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.7 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.468 ' HB3' HG12 ' A' ' 37' ' ' VAL . 7.3 t70 -67.4 111.01 3.82 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.424 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -45.36 88.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.33 -44.48 75.9 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.062 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.617 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.49 -54.9 29.03 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -58.19 -47.78 82.38 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.092 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -42.02 99.14 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.895 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.41 -49.42 74.56 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.837 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.447 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.79 -32.9 74.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.175 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -57.64 10.41 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.146 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -68.5 -31.32 70.49 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.572 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.5 -49.11 64.96 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.141 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 13' ' ' ALA . 59.2 t -71.0 -33.82 53.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.833 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -53.88 -35.58 61.73 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.988 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 . . . . . 0 C--O 1.232 0.154 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.259 179.402 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 N--CA 1.465 0.297 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.426 HG23 ' HB2' ' A' ' 41' ' ' GLN . 12.5 p -111.45 131.69 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.777 0.322 . . . . 0.0 111.634 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.543 HG12 ' HA ' ' A' ' 43' ' ' ALA . 18.0 pt -129.48 -41.55 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.638 ' CB ' HG22 ' A' ' 62' ' ' VAL . 27.9 p-90 -121.69 159.84 25.72 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.965 0.412 . . . . 0.0 111.802 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.61 HG12 ' HB3' ' A' ' 41' ' ' GLN . 12.4 m -142.84 148.08 20.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.588 178.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.612 HG22 ' HZ3' ' A' ' 26' ' ' TRP . 1.5 t -120.05 115.46 23.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.477 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 9.3 m-85 -79.64 121.1 24.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.607 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.71 164.75 17.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.87 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -78.66 113.26 16.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.899 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -132.42 108.93 9.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.664 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.54 37.63 58.11 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.521 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 m 64.38 26.85 13.62 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.706 0.288 . . . . 0.0 111.198 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -146.47 153.32 40.3 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.939 0.399 . . . . 0.0 110.735 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.445 HD12 ' O ' ' A' ' 4' ' ' LYS . 3.0 mp -84.08 128.88 38.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.468 HG12 ' HB3' ' A' ' 6' ' ' ASP . 19.6 m -145.11 144.92 25.16 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.884 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.617 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 36.5 Cg_exo -57.26 149.46 64.2 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -130.35 -153.47 7.73 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 121.21 -0.519 . . . . 0.0 112.467 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.581 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.9 mp0 -23.96 132.64 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.791 0.836 . . . . 0.0 112.74 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.61 ' HB3' HG12 ' A' ' 27' ' ' VAL . 3.4 pt20 -134.13 98.86 4.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.158 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.77 164.69 25.18 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.467 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 23' ' ' ALA . . . -88.34 -21.12 24.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.609 0.242 . . . . 0.0 110.805 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.12 115.36 28.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.729 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -68.35 -17.69 64.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.407 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.47 -40.84 27.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.664 0.269 . . . . 0.0 110.695 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -37.48 87.56 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.999 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.626 ' HZ ' ' HB2' ' A' ' 60' ' ' ALA . 5.8 t80 -67.84 -39.57 83.82 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.06 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 53.7 mt -68.46 -48.09 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.992 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.97 -36.19 76.6 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.685 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -24.61 27.49 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.528 ' SG ' HD21 ' A' ' 120' ' ' LEU . 1.3 m -74.66 82.39 2.05 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.829 0.347 . . . . 0.0 111.456 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.2 p -92.19 171.64 8.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.259 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.453 ' HB3' ' HG3' ' A' ' 84' ' ' GLU . 7.6 m-20 -86.27 19.06 2.85 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.563 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.694 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -134.79 71.95 1.45 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.674 0.273 . . . . 0.0 110.564 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.694 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -174.66 -172.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 120.939 0.399 . . . . 0.0 111.533 -179.363 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.79 102.67 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.18 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -149.53 177.64 9.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.528 ' CD1' HG23 ' A' ' 80' ' ' THR . 28.0 m-85 -110.36 171.79 7.25 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.626 ' HB2' ' HZ ' ' A' ' 48' ' ' PHE . . . -151.26 164.17 37.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.394 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -153.82 108.89 3.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.828 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.638 HG22 ' CB ' ' A' ' 26' ' ' TRP . 13.0 t -119.38 139.28 47.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -93.47 105.12 17.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.454 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.529 ' CG ' HD22 ' A' ' 129' ' ' LEU . 23.7 m-85 -84.69 141.84 30.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.756 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.851 0.358 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -138.88 139.54 38.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.753 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -104.77 123.57 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.878 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.633 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -136.64 136.01 38.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.15 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.429 HD21 ' HB3' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -107.33 106.59 17.1 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.379 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.413 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 2.0 mt -90.58 121.87 41.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.16 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.528 HG23 ' CD1' ' A' ' 59' ' ' PHE . 1.7 m -96.29 123.47 39.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.36 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.697 ' CE3' HD22 ' A' ' 120' ' ' LEU . 68.8 t-105 -111.13 134.38 52.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.891 0.377 . . . . 0.0 111.022 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 39.9 mt -137.75 105.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.031 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -68.84 116.57 7.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.624 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' HB3' ' A' ' 54' ' ' ASP . 0.1 OUTLIER -38.12 -30.34 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.657 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -72.94 36.24 0.08 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.031 0.444 . . . . 0.0 111.966 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.451 ' H ' ' C ' ' A' ' 84' ' ' GLU . 5.0 m -109.35 127.73 65.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.546 178.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.99 170.45 11.27 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.85 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.03 -42.17 47.38 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.672 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.4 -44.99 93.06 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.854 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -61.69 -41.73 97.97 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.878 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -61.23 -46.06 91.96 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.649 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.24 78.06 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.255 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -55.62 -55.05 36.56 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.856 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -38.55 71.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.58 -45.74 94.2 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.823 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.8 -45.37 36.43 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.668 0.234 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.887 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -59.76 -38.34 81.54 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.297 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -32.73 69.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.871 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.1 m -70.53 -42.73 70.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.441 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.887 HD12 ' HA ' ' A' ' 97' ' ' ASP . 6.4 mt -61.8 -50.07 73.81 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.084 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.514 ' HA ' HD13 ' A' ' 5' ' ' ILE . 13.0 p -62.65 -35.39 70.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.274 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -62.79 -41.79 99.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.714 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -62.83 -37.73 87.94 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.845 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 100' ' ' LEU . 39.7 t -63.79 -44.89 98.37 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.924 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -121.38 98.55 6.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -95.0 -24.85 16.74 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.555 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -80.16 83.65 5.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.787 0.327 . . . . 0.0 110.89 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -136.23 166.96 22.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.61 -55.35 2.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.318 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -132.74 147.65 52.32 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.288 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.429 ' HB3' HD21 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -152.0 124.58 8.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.992 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.611 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 13.4 p90 -158.55 161.1 37.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.382 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.455 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 8.7 p -109.31 140.39 28.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.781 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.587 HD11 ' HE1' ' A' ' 112' ' ' PHE . 8.5 mt -131.87 139.37 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 111.337 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.68 -26.24 10.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.947 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -83.9 138.67 33.05 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -35.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.525 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -68.19 -47.45 67.88 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.34 -27.9 68.25 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.204 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.697 HD22 ' CE3' ' A' ' 81' ' ' TRP . 1.3 tp -76.37 -28.48 56.79 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.6 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -50.59 135.17 23.39 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.102 0.477 . . . . 0.0 111.164 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.45 -31.65 46.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.121 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.38 -43.79 92.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.802 0.334 . . . . 0.0 110.599 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.38 -48.91 68.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.905 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.611 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 15.8 mt -61.96 -37.4 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.25 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.78 -40.49 63.24 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -73.08 -43.02 62.39 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.31 -49.41 74.1 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.185 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.633 HD11 ' CB ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -62.51 -45.47 92.85 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.271 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 43.2 tttt . . . . . 0 C--O 1.232 0.165 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.889 179.684 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.654 0.264 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -103.78 157.61 16.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.487 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.459 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.1 tt -128.73 118.83 48.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.471 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -79.97 112.01 16.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.918 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -37.41 58.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -55.37 35.56 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.099 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.679 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -59.53 -49.61 77.11 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.141 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.81 -46.88 84.05 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.899 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtt-85 -62.35 -46.31 89.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.926 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.16 -45.25 79.74 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.796 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.539 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -63.07 -46.52 87.06 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -56.3 -42.24 77.24 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.908 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.413 ' HA ' HD22 ' A' ' 16' ' ' LEU . 0.3 OUTLIER -65.13 -43.35 92.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.077 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.588 HG21 HG21 ' A' ' 27' ' ' VAL . 26.3 t -71.38 -31.05 42.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.259 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -39.38 58.91 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.929 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 C--O 1.233 0.22 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.608 179.456 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.6 t -114.46 132.16 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.746 0.308 . . . . 0.0 111.391 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.59 HG12 ' HA ' ' A' ' 43' ' ' ALA . 22.8 pt -129.67 -40.68 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.609 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.774 ' HB2' HG22 ' A' ' 62' ' ' VAL . 24.6 p-90 -123.74 154.24 39.76 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.879 0.371 . . . . 0.0 111.294 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.739 HG13 ' HG3' ' A' ' 41' ' ' GLN . 6.8 t -138.57 155.05 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.198 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.43 ' O ' ' N ' ' A' ' 39' ' ' GLY . 0.3 OUTLIER -98.63 169.91 9.17 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.545 179.246 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -150.91 95.87 2.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.995 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -122.01 170.03 10.24 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.969 0.414 . . . . 0.0 111.61 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -80.21 135.87 36.36 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.759 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.524 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.0 m-20 -153.7 116.52 4.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.09 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.83 40.29 75.22 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.928 -0.654 . . . . 0.0 113.014 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m 62.78 28.42 16.47 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.626 0.251 . . . . 0.0 111.494 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.5 t -156.0 149.1 24.39 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.6 mt -78.39 132.24 32.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.171 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.524 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 30.9 m -144.47 154.09 56.18 Favored Pre-proline 0 CA--C 1.531 0.217 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.679 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 36.5 Cg_endo -64.85 163.45 28.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.429 2.086 . . . . 0.0 112.306 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.18 -153.84 7.69 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.253 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.6 mp0 -36.13 141.74 0.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.739 ' HG3' HG13 ' A' ' 27' ' ' VAL . 8.1 mt-30 -135.71 111.71 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.85 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.75 168.11 34.85 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.543 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.59 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.08 -18.73 29.83 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.723 -0.239 . . . . 0.0 110.956 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.71 119.94 31.35 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.752 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.414 ' HD2' HD11 ' A' ' 49' ' ' ILE . 15.2 t80 -72.94 -23.11 60.64 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.611 ' HA ' HD12 ' A' ' 49' ' ' ILE . 15.8 tp60 -48.76 -37.33 18.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.637 0.256 . . . . 0.0 110.715 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -33.65 76.51 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.337 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.87 -42.54 63.57 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.687 0.28 . . . . 0.0 111.057 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 46' ' ' GLN . 9.6 mt -62.31 -40.55 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.137 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -69.2 -38.35 78.57 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.552 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.97 -42.73 60.04 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.44 -179.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 6.1 m -80.45 84.22 6.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.979 0.419 . . . . 0.0 111.803 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 p -96.89 161.8 13.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.551 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.489 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.5 m-20 -81.89 63.39 6.11 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.123 0.487 . . . . 0.0 111.299 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.744 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.8 t70 -170.08 43.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.741 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.744 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.1 150.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.525 -179.514 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.583 ' HD3' HG23 ' A' ' 94' ' ' THR . 0.0 OUTLIER -109.9 121.82 46.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.731 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.6 173.38 11.87 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -117.85 172.3 7.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.256 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.37 166.08 31.89 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.47 . . . . 0.0 111.667 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -144.77 112.21 6.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.824 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.774 HG22 ' HB2' ' A' ' 26' ' ' TRP . 17.5 t -126.14 137.14 58.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.932 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -119.45 124.95 47.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.59 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -111.99 161.8 16.05 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.266 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.233 0.231 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.375 179.289 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -148.16 138.42 22.72 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.947 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -94.07 147.08 23.48 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.552 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.54 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -143.53 142.04 30.97 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.596 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.93 105.15 16.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.389 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 25.4 mm -93.16 113.05 27.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.199 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.463 ' HB ' HG22 ' A' ' 113' ' ' VAL . 15.3 m -98.77 114.15 26.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.608 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -100.35 137.73 38.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.857 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.527 ' CG2' HG21 ' A' ' 86' ' ' VAL . 40.0 mt -138.57 97.37 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.489 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.95 109.7 3.06 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.382 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 86' ' ' VAL . 36.9 mt-10 -22.23 -46.34 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -179.017 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.736 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.2 m-80 -70.72 43.68 0.07 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.14 0.495 . . . . 0.0 111.935 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.527 HG21 ' CG2' ' A' ' 82' ' ' ILE . 4.1 t -78.61 145.51 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.277 178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.0 m -83.71 171.28 13.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.02 7.08 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.409 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mp -58.97 -37.3 76.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.72 0.295 . . . . 0.0 110.964 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.69 -34.88 77.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -30.42 71.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.538 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -85.07 -39.0 18.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.975 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -33.82 67.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.302 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.583 HG23 ' HD3' ' A' ' 57' ' ' ARG . 3.0 p -64.62 -42.09 95.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.543 0.211 . . . . 0.0 110.736 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.48 -49.44 76.65 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.12 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -73.64 -30.2 62.8 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 111.505 0.187 . . . . 0.0 111.505 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.646 ' HA ' HD12 ' A' ' 100' ' ' LEU . 9.9 t0 -58.69 -42.73 89.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.7 0.286 . . . . 0.0 111.039 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -53.77 -32.73 53.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.128 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.9 m -74.98 -41.5 59.41 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.006 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 97' ' ' ASP . 16.8 mt -61.66 -49.23 77.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.364 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.501 ' HA ' HG12 ' A' ' 104' ' ' VAL . 58.6 t -64.65 -37.65 80.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.911 179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -61.85 -34.96 76.92 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.042 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -75.18 -47.5 28.03 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.442 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.793 HG13 HG23 ' A' ' 105' ' ' VAL . 13.7 p -66.54 -38.32 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.499 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.793 HG23 HG13 ' A' ' 104' ' ' VAL . 43.7 t -127.8 121.5 56.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 120.772 0.32 . . . . 0.0 110.967 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -120.17 3.29 10.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.961 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -89.43 74.55 7.75 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.913 0.387 . . . . 0.0 111.073 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -145.8 147.69 32.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.148 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.82 -41.85 15.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.372 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.55 ' HD2' HD22 ' A' ' 129' ' ' LEU . 0.1 OUTLIER -152.28 160.47 43.34 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.813 0.339 . . . . 0.0 111.181 -179.776 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -150.6 122.64 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.892 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -137.47 166.22 24.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 111.123 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.463 HG22 ' HB ' ' A' ' 80' ' ' THR . 25.5 t -110.37 139.57 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.631 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.527 HG22 ' H ' ' A' ' 116' ' ' ASP . 32.7 mm -131.53 151.1 34.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.105 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.1 t -147.1 29.8 0.97 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.017 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.527 ' H ' HG22 ' A' ' 114' ' ' ILE . 35.4 t70 -137.52 136.08 37.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.58 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.89 -35.91 82.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.289 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.8 tttm -65.9 -41.87 90.96 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.46 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -73.49 -33.11 64.66 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.59 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.428 ' HA ' HD23 ' A' ' 120' ' ' LEU . 5.0 mt -61.02 -34.15 74.39 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.432 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -43.43 130.31 5.03 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.333 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -49.69 -36.87 26.64 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.922 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -60.58 -42.6 97.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.893 0.378 . . . . 0.0 110.22 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -69.77 -49.71 50.37 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.952 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.4 mm -55.98 -46.51 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -66.81 -34.7 78.38 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.172 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.3 t -61.97 -48.81 78.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.828 0.347 . . . . 0.0 110.255 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.35 -32.21 71.15 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.712 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.55 HD22 ' HD2' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -53.44 -47.47 69.64 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.644 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.591 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -107.98 103.22 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.69 HD12 ' HB ' ' A' ' 36' ' ' ILE . 0.9 OUTLIER -80.01 113.37 19.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.556 179.785 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.419 ' HB3' HG12 ' A' ' 37' ' ' VAL . 16.7 t0 -72.02 106.79 4.42 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HD3' HG23 ' A' ' 104' ' ' VAL . 1.3 mmmp? -68.26 -40.3 81.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.676 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -60.98 -45.95 92.73 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.752 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -59.65 -57.05 14.61 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.633 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 46.3 t -57.17 -42.83 81.84 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -41.99 96.27 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.906 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.76 -52.85 58.89 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.926 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.457 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.43 -33.46 76.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.158 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.526 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -55.96 -57.13 13.4 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.334 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -69.9 -29.81 67.09 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.618 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.46 -48.51 79.3 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.645 0.26 . . . . 0.0 111.128 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 13' ' ' ALA . 47.7 t -69.4 -33.74 58.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.45 -18.3 60.66 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.823 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 111.249 -179.877 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.445 ' CG1' ' HB3' ' A' ' 41' ' ' GLN . 48.2 t -141.33 109.42 2.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.746 0.308 . . . . 0.0 110.849 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.41 HG12 ' HA ' ' A' ' 43' ' ' ALA . 2.2 pt -108.18 -28.84 2.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.542 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.563 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 43.9 p-90 -128.71 158.15 39.38 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.891 0.377 . . . . 0.0 111.312 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.619 HG12 ' HG2' ' A' ' 41' ' ' GLN . 29.2 m -142.34 143.99 25.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.154 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.561 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 3.6 m -82.38 168.09 17.86 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.472 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.452 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 7.7 m-85 -147.46 108.9 4.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 110.496 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -143.88 148.87 36.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 35' ' ' THR . 43.7 p90 -98.18 133.69 42.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.569 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.35 108.44 19.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.211 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.0 -71.37 2.21 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.123 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 p -159.8 33.71 0.18 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.205 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 3.3 t -145.47 126.39 14.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.69 ' HB ' HD12 ' A' ' 5' ' ' ILE . 33.3 mt -83.94 133.28 29.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.419 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.3 m -152.98 156.28 32.64 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.752 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.4 Cg_endo -65.86 160.05 45.88 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.6 2.2 . . . . 0.0 112.242 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.561 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.69 -146.67 6.09 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.494 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.563 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.29 137.32 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.083 0.553 . . . . 0.0 112.412 -179.185 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.619 ' HG2' HG12 ' A' ' 27' ' ' VAL . 35.5 mt-30 -135.22 114.44 12.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.329 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -149.99 160.94 28.72 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.757 -0.735 . . . . 0.0 113.338 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.41 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.12 -25.92 36.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.571 0.224 . . . . 0.0 110.815 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.42 121.37 38.15 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.511 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.92 -20.4 64.23 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -37.15 9.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.748 0.309 . . . . 0.0 111.042 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -42.96 99.48 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.678 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 56.4 t80 -66.88 -45.28 78.54 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.719 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 55.0 mt -61.42 -36.14 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -59.5 -47.06 86.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.016 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.88 -17.33 47.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.853 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.657 ' SG ' HD21 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -70.86 83.51 0.65 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.115 0.483 . . . . 0.0 111.592 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.2 p -111.09 146.21 37.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.458 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.516 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 2.3 m-20 -78.96 59.94 2.77 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.84 0.352 . . . . 0.0 111.699 -179.146 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.747 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.6 t70 -157.85 36.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.989 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.747 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -179.36 174.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.022 -179.759 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.569 ' HG2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -124.77 133.76 53.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.928 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.39 164.03 32.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.988 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.452 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 18.9 m-85 -105.87 166.19 10.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.925 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.678 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -143.87 155.52 44.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.578 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.449 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 1.2 t80 -152.07 135.53 16.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.503 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.21 141.93 12.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.855 0.36 . . . . 0.0 111.308 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD2' ' CE2' ' A' ' 76' ' ' PHE . 11.0 ttp180 -108.9 154.44 22.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.462 ' CD1' HD22 ' A' ' 129' ' ' LEU . 71.9 m-85 -125.47 150.47 47.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.656 179.859 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.702 0.286 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -139.83 143.63 36.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.156 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.48 ' CE2' ' HD2' ' A' ' 63' ' ' ARG . 5.5 m-85 -119.18 136.14 54.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.714 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -142.55 140.76 31.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.962 0.411 . . . . 0.0 111.718 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HG ' ' CD2' ' A' ' 61' ' ' PHE . 1.2 tt -109.15 119.66 40.2 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.241 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.451 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 2.2 mp -113.33 127.88 70.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 0.0 111.363 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.631 ' HB ' HG23 ' A' ' 113' ' ' VAL . 1.1 m -102.82 132.68 48.83 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.236 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.714 ' CE3' HD22 ' A' ' 120' ' ' LEU . 55.3 t-105 -109.36 123.96 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.902 0.382 . . . . 0.0 111.421 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.557 HD11 ' HD3' ' A' ' 91' ' ' ARG . 1.9 tt -114.91 100.32 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.861 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.516 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -71.35 73.2 0.75 Allowed Glycine 0 C--N 1.333 0.368 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.932 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 24.11 -75.22 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' A' ' 83' ' ' GLY . 49.5 m-80 -49.0 -18.06 0.26 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.548 HG21 HG13 ' A' ' 82' ' ' ILE . 16.7 t -36.75 109.24 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 O-C-N 123.229 0.33 . . . . 0.0 111.608 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.8 m -61.3 168.81 2.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.676 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.07 -48.25 86.83 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.467 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 89' ' ' LEU . 10.3 tp -57.34 -38.9 74.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.695 0.283 . . . . 0.0 110.533 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.569 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 24.5 mm-40 -68.73 -37.83 79.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.399 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.557 ' HD3' HD11 ' A' ' 82' ' ' ILE . 1.3 mmm180 -59.47 -51.45 69.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.431 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.53 87.71 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.94 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.98 -46.0 82.51 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.461 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 63.2 m -60.99 -44.46 97.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.72 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.22 -52.39 49.8 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.703 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.38 -37.43 85.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.59 0.233 . . . . 0.0 110.938 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.667 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.1 m-20 -57.91 -40.86 81.4 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.945 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -62.46 -29.75 70.75 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.015 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.6 m -67.79 -47.24 69.66 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.722 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' A' ' 97' ' ' ASP . 1.4 mt -61.98 -42.54 99.25 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.965 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 97' ' ' ASP . 41.0 t -67.96 -31.68 53.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.78 -41.12 96.09 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.932 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.45 -52.68 43.78 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.13 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.785 HG13 HG23 ' A' ' 105' ' ' VAL . 7.6 p -64.29 -34.27 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.3 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.785 HG23 HG13 ' A' ' 104' ' ' VAL . 41.1 t -119.29 89.92 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 120.912 0.387 . . . . 0.0 110.713 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -101.52 -24.37 14.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -77.63 84.17 4.0 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.923 0.392 . . . . 0.0 110.841 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.423 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.6 p90 -146.04 164.17 32.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.872 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.52 -47.7 8.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.169 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -165.18 161.86 19.67 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.135 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -150.6 138.89 20.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.789 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -147.0 168.52 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.978 0.418 . . . . 0.0 111.288 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.631 HG23 ' HB ' ' A' ' 80' ' ' THR . 8.8 p -119.15 139.33 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 113' ' ' VAL . 38.9 mm -129.69 151.96 36.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.987 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 14.9 m -109.94 -29.28 8.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.244 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -101.42 149.64 23.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.812 0.339 . . . . 0.0 110.872 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -69.44 -21.28 63.74 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.884 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -61.79 -57.74 10.68 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.114 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -75.19 -22.34 58.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.582 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.714 HD22 ' CE3' ' A' ' 81' ' ' TRP . 3.6 tp -80.23 -25.7 39.46 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.737 -0.21 . . . . 0.0 111.066 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -52.77 144.75 13.62 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.288 0.566 . . . . 0.0 111.667 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -53.38 -33.36 53.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.603 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -41.0 85.4 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.91 0.386 . . . . 0.0 110.446 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -71.34 -45.23 63.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.88 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.478 HG22 HD13 ' A' ' 129' ' ' LEU . 42.7 mt -61.32 -49.09 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.954 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -33.52 70.72 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.284 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.6 t -79.23 -43.95 22.78 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -63.07 -45.67 91.06 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.169 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.714 HD21 ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -68.28 -23.81 64.8 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.665 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 20.4 tttm . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.613 0.244 . . . . 0.0 111.11 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 34' ' ' SER . 28.0 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.767 0.318 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 35' ' ' THR . 9.2 mttp -95.13 169.79 9.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.822 HD12 HD12 ' A' ' 36' ' ' ILE . 3.4 tt -129.33 124.87 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.576 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.33 106.11 5.81 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.645 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -39.05 84.65 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.754 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -52.52 64.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.957 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -66.8 -52.96 37.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.293 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.2 m -53.11 -46.96 68.94 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.27 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -65.14 -41.67 94.55 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.716 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.52 75.01 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.665 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.88 99.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.77 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.668 ' HE2' HG13 ' A' ' 105' ' ' VAL . 4.3 t80 -59.25 -42.11 90.35 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.979 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -66.52 -41.46 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.065 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 tp -71.28 -48.27 51.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.639 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.08 -29.51 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.336 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -61.19 -34.15 74.61 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.624 0.249 . . . . 0.0 110.703 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 . . . . . 0 C--O 1.235 0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.381 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.5 t -132.17 98.53 3.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.703 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -104.61 -30.93 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 30.4 p-90 -132.28 157.97 43.02 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.881 0.372 . . . . 0.0 111.582 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -141.63 149.27 20.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.466 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.526 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 90.3 m -88.93 162.47 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.893 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.413 ' N ' HG22 ' A' ' 28' ' ' THR . 9.8 m-85 -148.23 96.41 2.62 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.811 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -123.67 152.56 41.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.452 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -105.56 118.07 35.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.95 0.405 . . . . 0.0 111.054 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.11 90.55 0.87 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.43 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.45 -57.52 4.12 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.491 ' O ' HG23 ' A' ' 3' ' ' THR . 1.7 t -149.66 -35.62 0.17 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 11.3 t -80.28 130.32 35.12 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.924 0.393 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.822 HD12 HD12 ' A' ' 5' ' ' ILE . 33.0 mt -79.29 141.01 15.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.08 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.542 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.5 p -158.59 138.31 8.59 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.049 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 19.4 Cg_endo -59.6 162.61 14.81 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.68 2.253 . . . . 0.0 112.378 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.526 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -131.54 -150.83 6.76 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 121.25 -0.5 . . . . 0.0 112.712 -179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.548 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -38.72 141.44 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.242 0.617 . . . . 0.0 112.47 -179.037 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -139.32 98.83 3.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.142 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.83 165.86 23.76 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.332 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.491 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.1 -21.92 25.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.627 0.251 . . . . 0.0 110.865 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -97.28 128.06 43.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.536 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -73.95 -20.13 60.46 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.652 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.521 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -48.21 -40.74 25.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.828 0.347 . . . . 0.0 110.36 179.46 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -39.38 88.23 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.263 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.569 ' HZ ' ' HB2' ' A' ' 60' ' ' ALA . 6.4 t80 -69.03 -45.22 71.02 Favored 'General case' 0 C--N 1.338 0.066 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.736 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 46' ' ' GLN . 26.7 mt -57.4 -40.54 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.324 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -68.04 -39.53 83.03 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.03 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -89.98 0.03 57.32 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.5 t -110.03 87.4 2.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.88 0.372 . . . . 0.0 111.425 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.33 176.77 5.59 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.448 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.84 19.58 1.68 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -133.07 75.68 1.64 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.714 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.21 -172.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.837 0.351 . . . . 0.0 111.813 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -166.62 96.31 0.55 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.365 179.725 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 pp -151.92 173.31 14.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.443 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -107.06 163.71 12.76 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.134 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HB2' ' HZ ' ' A' ' 48' ' ' PHE . . . -143.11 161.42 38.24 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.022 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -148.05 126.94 12.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -134.99 138.5 48.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.185 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -102.02 106.4 17.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.497 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -108.92 140.0 43.0 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.994 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.4 m . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.928 -179.728 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.233 0.198 0 CA-C-O 120.658 0.266 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -146.54 146.23 30.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.4 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 34.2 m-85 -99.95 130.79 46.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.417 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.596 ' HB2' HD12 ' A' ' 129' ' ' LEU . . . -122.75 127.03 48.65 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.292 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.0 tt -100.94 107.2 18.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.382 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.586 ' CG2' HD12 ' A' ' 114' ' ' ILE . 3.1 mt -99.83 105.03 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.503 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.9 p -88.95 116.53 27.31 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.847 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.418 ' HZ3' HG22 ' A' ' 114' ' ' ILE . 74.9 t-105 -100.25 140.57 34.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.078 0.465 . . . . 0.0 111.82 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 mt -144.57 101.2 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.653 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.33 124.52 9.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.261 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -33.07 -46.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.722 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.0 m-80 -56.05 -10.92 0.92 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -51.98 125.68 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.998 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.09 162.84 28.58 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.64 -50.7 52.61 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.813 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.29 -39.51 87.16 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.772 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.481 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 71.6 mm-40 -61.95 -44.58 96.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -57.06 -48.12 79.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.743 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.41 -44.72 89.16 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.647 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -56.58 -54.58 44.28 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.291 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -48.74 -40.17 27.61 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.489 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.26 -52.37 53.0 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.963 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.719 ' O ' HG22 ' A' ' 99' ' ' THR . 0.6 OUTLIER -62.5 -37.48 86.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.305 . . . . 0.0 110.786 179.257 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.481 ' O ' HG23 ' A' ' 101' ' ' VAL . 22.6 m-20 -70.06 -35.7 74.42 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.195 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -31.79 71.94 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.299 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 96' ' ' THR . 7.0 t -81.02 -33.33 33.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.951 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.449 ' O ' HG23 ' A' ' 104' ' ' VAL . 36.0 mt -64.22 -43.81 93.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 97' ' ' ASP . 39.6 t -68.02 -42.53 85.38 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -37.41 76.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.0 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.12 -42.51 93.87 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.761 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 100' ' ' LEU . 43.4 t -69.58 -41.34 80.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.909 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.668 HG13 ' HE2' ' A' ' 14' ' ' TYR . 36.3 t -114.1 97.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.949 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -96.18 -22.24 17.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.567 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.6 80.44 5.98 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.965 0.412 . . . . 0.0 110.514 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -129.27 172.91 11.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.734 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -117.34 -53.95 2.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.531 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.1 125.57 13.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.776 0.322 . . . . 0.0 111.494 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.43 128.35 47.95 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.557 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.408 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 4.4 p90 -144.1 161.75 38.01 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.987 0.422 . . . . 0.0 111.514 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.6 t -100.81 141.99 16.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.392 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.586 HD12 ' CG2' ' A' ' 79' ' ' ILE . 31.7 mt -135.94 135.78 50.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 21.3 t -118.58 -15.98 9.51 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.991 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -115.0 151.89 33.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 111.03 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -21.96 66.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.354 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -55.8 22.11 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.576 0.227 . . . . 0.0 110.792 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.475 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 0.6 OUTLIER -73.88 -30.03 62.4 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.542 ' N ' HG21 ' A' ' 114' ' ' ILE . 0.9 OUTLIER -68.72 -25.85 64.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.689 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.04 136.98 56.32 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -53.21 -29.94 34.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.924 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -59.91 -47.16 86.92 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.945 0.402 . . . . 0.0 110.425 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.475 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 30.8 t80 -68.21 -48.36 65.42 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.862 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.408 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 59.6 mt -54.61 -43.74 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -43.29 80.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.179 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -47.54 76.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.819 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.63 -42.83 97.7 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.118 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.596 HD12 ' HB2' ' A' ' 77' ' ' ALA . 5.2 tt -70.23 -31.97 69.63 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.249 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.53 0.191 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.738 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 t . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 120.718 0.294 . . . . 0.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' O ' ' HA ' ' A' ' 35' ' ' THR . 12.2 mttp -99.51 151.42 21.17 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.065 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.511 HG13 ' HB ' ' A' ' 36' ' ' ILE . 3.8 tt -116.71 128.96 73.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.37 106.67 16.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -58.57 -37.34 75.54 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.215 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.27 -49.81 76.41 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.912 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.86 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.56 -53.89 44.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.307 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' HG11 ' A' ' 104' ' ' VAL . 1.7 t -53.54 -43.04 68.09 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.187 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -68.78 -43.07 76.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.64 -45.97 73.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.697 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -64.52 -48.39 75.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.84 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -53.39 -46.57 69.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.855 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -57.52 -43.52 84.36 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.019 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.28 -40.84 81.72 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.077 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 13' ' ' ALA . 42.8 t -64.69 -42.01 93.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.842 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.6 -41.27 80.9 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.631 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.233 0.234 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.641 179.528 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 N--CA 1.465 0.315 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 41' ' ' GLN . 42.9 t -124.89 114.31 39.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 111.22 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.466 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -107.41 -30.16 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.434 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -131.27 154.87 48.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.878 0.371 . . . . 0.0 111.173 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.514 ' CG1' HG22 ' A' ' 17' ' ' VAL . 34.2 m -142.17 146.77 22.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.261 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.22 170.71 9.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.995 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -148.56 98.96 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.36 179.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.26 -179.57 3.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.013 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 35.2 p90 -140.8 128.56 21.67 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.023 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.44 ' O ' HG22 ' A' ' 35' ' ' THR . 1.1 t70 -96.9 107.16 19.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.397 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.59 -77.56 1.07 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.161 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.72 38.31 0.47 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.753 0.311 . . . . 0.0 111.359 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.44 HG22 ' O ' ' A' ' 32' ' ' ASP . 2.6 t -140.77 122.73 15.52 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.898 0.38 . . . . 0.0 110.987 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.511 ' HB ' HG13 ' A' ' 5' ' ' ILE . 4.0 mm -79.47 133.44 29.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.94 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.564 HG23 ' HB1' ' A' ' 9' ' ' ALA . 9.8 p -157.09 139.0 10.11 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.005 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.86 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 15.6 Cg_endo -56.34 162.75 7.39 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.61 2.207 . . . . 0.0 112.329 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -127.06 -157.96 9.66 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.387 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.5 mp0 -32.63 139.11 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.782 0.833 . . . . 0.0 112.611 -179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.464 ' HB3' HG11 ' A' ' 24' ' ' VAL . 22.3 mt-30 -136.4 91.78 2.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.408 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.18 168.5 21.44 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 113.317 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.466 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -94.21 -15.23 24.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.754 -0.223 . . . . 0.0 111.187 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -96.72 129.61 44.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -78.42 -17.09 56.88 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.717 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -49.76 -40.57 41.61 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.765 0.317 . . . . 0.0 110.601 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.91 -36.17 81.65 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.928 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.525 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 8.1 t80 -60.7 -46.7 89.38 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.761 0.315 . . . . 0.0 110.788 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 25.1 mt -63.94 -41.47 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -70.42 -40.05 74.07 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.715 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.16 -42.01 69.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.535 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -73.71 81.91 1.57 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.921 0.391 . . . . 0.0 111.265 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 p -117.4 155.83 28.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.56 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.479 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 7.2 m-20 -72.33 69.53 0.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.203 0.525 . . . . 0.0 110.95 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.734 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.5 t70 -170.03 46.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.098 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.668 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.66 -171.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.885 0.374 . . . . 0.0 111.935 -178.457 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.755 ' HB3' HG12 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -160.99 94.51 1.02 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.565 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 177.11 11.58 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.849 0.357 . . . . 0.0 111.675 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.741 ' CD2' HG23 ' A' ' 80' ' ' THR . 28.7 m-85 -109.74 163.43 13.51 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.462 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.525 ' HB1' ' CE2' ' A' ' 48' ' ' PHE . . . -147.42 141.48 26.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.084 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.537 ' HE1' HD12 ' A' ' 78' ' ' LEU . 1.5 t80 -122.39 135.42 54.69 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.021 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -137.24 136.17 47.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.179 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -101.76 127.1 48.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.826 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -107.56 151.22 25.89 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.184 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.155 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.658 0.266 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -137.9 144.03 41.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.891 0.377 . . . . 0.0 111.402 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.563 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 3.6 m-85 -94.0 134.99 35.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.795 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -135.95 106.27 6.41 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.892 0.377 . . . . 0.0 111.429 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.537 HD12 ' HE1' ' A' ' 61' ' ' PHE . 7.7 tt -96.35 117.05 30.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.41 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.413 HG21 ' CD2' ' A' ' 120' ' ' LEU . 2.1 mp -118.87 119.94 62.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 120.878 0.37 . . . . 0.0 111.345 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.741 HG23 ' CD2' ' A' ' 59' ' ' PHE . 1.5 m -88.08 138.58 31.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.235 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.668 ' CE3' HD12 ' A' ' 120' ' ' LEU . 52.5 t-105 -115.54 125.98 53.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.912 0.387 . . . . 0.0 111.192 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.668 HG13 HG11 ' A' ' 86' ' ' VAL . 3.3 tt -123.59 81.4 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.523 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.546 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -62.48 126.05 36.89 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.572 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -29.62 -34.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.734 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.7 m-80 -73.93 39.64 0.11 Allowed 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.135 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.755 HG12 ' HB3' ' A' ' 57' ' ' ARG . 4.7 m -96.46 112.08 27.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.505 178.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.9 170.15 16.8 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.154 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -46.03 -50.65 12.04 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.493 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.67 -35.94 81.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.625 0.212 . . . . 0.0 111.513 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.465 ' HG3' ' HG3' ' A' ' 57' ' ' ARG . 3.0 mp0 -65.09 -39.93 93.87 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.997 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -50.68 -50.42 54.88 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.837 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.22 -38.58 68.96 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -55.33 -40.68 71.48 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.366 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.5 m -53.26 -46.91 69.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.151 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.06 -50.4 65.78 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.001 -0.618 . . . . 0.0 112.624 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.5 p -62.66 -41.22 98.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.562 0.22 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -66.64 -40.87 88.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.09 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -30.21 68.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.772 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.5 m -71.9 -42.68 66.46 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.774 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -56.52 -56.07 25.88 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.19 -36.55 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.963 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -45.1 89.94 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.907 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.07 -38.05 84.86 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.554 HG11 ' SG ' ' A' ' 10' ' ' CYS . 20.3 t -73.74 -43.54 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.35 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.89 100.25 10.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.926 0.393 . . . . 0.0 111.118 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -103.47 -29.34 11.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.573 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.78 83.81 4.9 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.14 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -138.19 -179.14 5.61 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.736 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -109.6 -67.19 1.0 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.387 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -134.87 144.57 47.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.41 137.05 43.74 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.582 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 8.7 p90 -155.66 173.98 15.95 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.101 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.535 HG23 ' HB ' ' A' ' 80' ' ' THR . 9.9 p -124.41 141.01 45.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.404 HD12 ' HB3' ' A' ' 119' ' ' GLU . 30.8 mm -126.22 153.37 34.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.15 -179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 m -117.59 -24.74 7.16 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -117.81 146.81 43.58 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.941 0.4 . . . . 0.0 111.168 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -62.57 -28.04 69.6 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.594 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.87 -45.76 91.47 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.667 0.27 . . . . 0.0 110.886 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.404 ' HB3' HD12 ' A' ' 114' ' ' ILE . 1.8 mt-10 -77.55 -31.5 53.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.8 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.841 HD23 HD11 ' A' ' 125' ' ' ILE . 0.4 OUTLIER -79.76 -2.23 42.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.732 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.07 132.23 53.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.931 0.396 . . . . 0.0 110.523 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.39 -37.76 49.93 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.609 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.5 -43.1 99.46 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.28 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -67.94 -51.54 46.43 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.834 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.841 HD11 HD23 ' A' ' 120' ' ' LEU . 63.7 mt -57.71 -50.44 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -55.05 -42.09 72.27 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.185 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -40.69 94.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.045 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -63.14 -56.8 13.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.577 HD23 HG22 ' A' ' 125' ' ' ILE . 2.8 pp -63.81 -23.54 67.4 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.609 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.8 tttt . . . . . 0 CA--C 1.53 0.197 0 CA-C-O 120.421 0.153 . . . . 0.0 110.911 179.431 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 t . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.837 0.351 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -179.55 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.565 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.567 ' HB ' HD12 ' A' ' 36' ' ' ILE . 2.5 tt -130.72 133.32 63.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.747 0.308 . . . . 0.0 111.16 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -83.13 96.17 8.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.37 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -59.83 -42.92 94.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.244 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.98 -49.81 74.62 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.323 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.429 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -70.27 -50.94 34.49 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 40.8 m -55.35 -42.9 74.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -66.11 -47.23 74.85 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.516 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.28 -44.19 71.68 Favored 'General case' 0 CA--C 1.527 0.06 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.894 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.528 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -66.62 -37.48 84.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.252 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -55.13 -60.07 3.89 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.15 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -63.96 -29.48 70.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.526 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.947 HD23 HG11 ' A' ' 24' ' ' VAL . 4.0 tt -62.55 -44.54 96.07 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.714 0.293 . . . . 0.0 110.603 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 13' ' ' ALA . 52.3 t -68.2 -34.63 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.58 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -60.3 -35.99 76.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.412 179.335 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.947 HG11 HD23 ' A' ' 16' ' ' LEU . 14.2 p -118.34 117.77 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.519 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.684 HD12 HG13 ' A' ' 62' ' ' VAL . 1.1 pt -121.57 -31.56 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.538 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 32.2 p-90 -130.87 158.42 40.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.951 0.405 . . . . 0.0 111.384 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.769 HG12 ' HG2' ' A' ' 41' ' ' GLN . 14.5 m -144.52 145.18 21.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.23 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.495 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 16.7 p -105.7 100.23 9.8 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.812 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' A' ' 59' ' ' PHE . 3.8 m-85 -78.89 109.62 13.34 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.666 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -128.45 135.58 49.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.593 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -91.69 123.7 35.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.98 123.33 45.69 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.715 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.1 -83.04 0.74 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.357 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.94 31.06 0.56 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.5 t -149.82 139.22 21.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.744 0.307 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.567 HD12 ' HB ' ' A' ' 5' ' ' ILE . 7.0 mt -85.09 137.77 20.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.901 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.415 HG23 ' CB ' ' A' ' 9' ' ' ALA . 10.0 p -155.15 141.26 12.96 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.499 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.439 ' HG3' ' CZ ' ' A' ' 29' ' ' PHE . 37.8 Cg_exo -57.56 154.34 36.92 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.555 2.17 . . . . 0.0 112.515 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -128.45 -155.74 8.75 Favored Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 121.325 -0.464 . . . . 0.0 112.082 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.5 mp0 -24.52 130.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.727 0.811 . . . . 0.0 112.643 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.769 ' HG2' HG12 ' A' ' 27' ' ' VAL . 31.0 mt-30 -131.69 98.13 4.4 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.32 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.85 164.33 24.98 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.482 -0.866 . . . . 0.0 113.32 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.596 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -89.67 -20.66 23.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.62 0.248 . . . . 0.0 110.889 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.81 126.49 37.91 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.795 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 12.9 t80 -70.79 -19.13 62.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.671 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -46.98 -41.94 17.12 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.745 0.307 . . . . 0.0 110.643 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.89 -36.68 82.83 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.937 178.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -58.68 -49.34 77.93 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.099 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.3 mt -70.85 -42.61 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.67 -45.43 94.16 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.027 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -76.39 -31.01 57.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.8 m -75.29 84.55 2.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.056 0.455 . . . . 0.0 111.5 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p -93.17 169.67 10.22 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.15 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -85.46 17.43 3.19 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.721 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -133.67 67.86 1.51 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.296 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.721 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -177.35 -172.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.386 -179.096 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.746 ' HD3' HG12 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -159.06 114.91 2.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.778 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 pp -158.31 154.06 26.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.827 0.346 . . . . 0.0 111.537 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 1.5 m-85 -107.05 98.98 8.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.407 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -107.92 157.41 18.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.767 ' HB3' HD23 ' A' ' 78' ' ' LEU . 31.7 p90 -152.37 164.29 37.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.262 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.684 HG13 HD12 ' A' ' 25' ' ' ILE . 4.4 t -137.41 152.54 27.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.364 -179.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -113.26 104.11 12.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.633 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -103.7 173.33 6.35 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.22 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.274 179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.761 0.315 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.426 ' HD3' ' HB1' ' A' ' 109' ' ' ALA . 24.5 mttm -151.73 146.33 25.68 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.953 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.595 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 76.1 m-85 -92.98 170.68 9.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.116 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.666 ' HB2' ' CD1' ' A' ' 129' ' ' LEU . . . -154.87 105.54 2.58 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.767 HD23 ' HB3' ' A' ' 61' ' ' PHE . 7.4 mt -80.99 134.64 35.73 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.203 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.514 ' CG2' HD12 ' A' ' 114' ' ' ILE . 21.4 mt -129.8 105.43 12.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.027 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.864 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.3 OUTLIER -80.23 97.04 6.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.208 179.601 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.41 ' CZ3' HD12 ' A' ' 120' ' ' LEU . 71.2 t-105 -89.22 135.03 33.79 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 41.4 mt -141.58 101.4 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.78 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.68 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -68.08 117.06 8.17 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.026 -0.606 . . . . 0.0 112.221 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.435 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.2 mt-10 -32.04 -40.3 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -179.005 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.709 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.0 m-80 -71.28 42.0 0.07 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 111.942 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.746 HG12 ' HD3' ' A' ' 57' ' ' ARG . 2.7 m -95.49 135.2 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.491 178.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.16 164.49 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.47 83.47 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.024 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 tp -66.46 -32.14 73.32 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.622 0.211 . . . . 0.0 111.317 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -59.25 -40.21 85.25 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.959 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -40.45 80.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.18 -39.36 40.99 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -58.45 -46.32 86.79 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.011 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -42.28 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.193 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.43 -46.65 93.57 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.191 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.1 -43.13 68.32 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.646 0.26 . . . . 0.0 110.837 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.646 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.7 m-20 -61.6 -38.79 88.88 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.422 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.73 -30.62 70.09 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.681 0.277 . . . . 0.0 110.664 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 23.3 m -71.54 -41.82 68.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.412 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 97' ' ' ASP . 8.7 mt -63.33 -51.24 66.81 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.39 -30.58 49.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.312 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -65.55 -45.12 84.61 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.638 0.256 . . . . 0.0 110.676 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -38.69 81.99 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.831 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 26.2 t -78.26 -37.04 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.971 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -129.8 83.31 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.94 0.4 . . . . 0.0 110.751 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.0 -35.63 7.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.196 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.97 77.83 2.85 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -124.73 179.39 5.0 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -92.17 -59.36 2.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.5 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.85 154.29 51.22 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.751 0.31 . . . . 0.0 111.359 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -148.88 135.6 19.7 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.174 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.662 ' HE2' HD11 ' A' ' 114' ' ' ILE . 13.7 p90 -160.44 159.32 30.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.927 0.394 . . . . 0.0 111.292 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.864 HG12 ' HB ' ' A' ' 80' ' ' THR . 2.6 m -100.3 147.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.992 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.662 HD11 ' HE2' ' A' ' 112' ' ' PHE . 59.6 mt -142.18 140.62 29.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.956 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 54.6 m -140.49 31.57 1.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.413 ' H ' HG22 ' A' ' 114' ' ' ILE . 33.1 t70 -145.8 134.57 22.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.488 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -34.06 74.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.948 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -69.08 -41.09 78.0 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.681 0.277 . . . . 0.0 110.485 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.71 -32.85 64.11 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.666 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.41 HD12 ' CZ3' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -69.12 -24.94 64.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.577 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.91 135.2 12.66 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.045 0.45 . . . . 0.0 111.336 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -50.79 -33.74 24.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.094 -179.538 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -38.34 73.22 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 110.309 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -76.14 -46.2 29.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.714 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.497 HG21 HD11 ' A' ' 79' ' ' ILE . 29.3 mm -60.19 -51.47 72.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.225 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.0 -42.79 95.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.684 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.1 t -62.78 -43.36 99.01 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.571 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.02 -42.44 90.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.092 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.666 ' CD1' ' HB2' ' A' ' 77' ' ' ALA . 2.2 tp -64.42 -43.14 95.29 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.446 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 32.7 tttp . . . . . 0 C--O 1.232 0.142 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.26 -179.807 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -88.62 150.81 22.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.072 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 tt -120.86 124.3 72.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.596 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.08 112.92 9.57 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.911 0.386 . . . . 0.0 110.806 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -72.24 -42.97 65.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.925 -179.834 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -57.06 -51.45 69.22 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.019 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.729 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.15 -50.78 71.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.3 t -57.35 -44.24 84.13 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.211 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -65.78 -42.0 91.31 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.35 -47.91 68.97 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.747 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.17 84.6 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.666 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -59.26 -37.58 77.95 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.124 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -69.98 -44.25 69.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.284 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -46.88 67.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.102 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.92 -24.91 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.39 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -39.84 66.68 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.881 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 C--O 1.234 0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.571 179.655 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.96 0.41 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.547 HG11 ' CD ' ' A' ' 41' ' ' GLN . 40.2 t -142.59 125.0 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.468 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -127.01 -29.28 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.575 ' HB2' HG22 ' A' ' 62' ' ' VAL . 32.7 p-90 -132.96 157.65 44.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.952 0.406 . . . . 0.0 111.727 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.62 HG13 ' HG3' ' A' ' 41' ' ' GLN . 2.3 t -139.07 150.52 23.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.255 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.43 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 73.7 m -90.99 159.97 15.87 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.492 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -145.29 93.16 2.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.208 0.528 . . . . 0.0 110.558 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -113.31 179.14 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -143.78 130.32 20.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.979 0.419 . . . . 0.0 111.427 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.8 -149.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.271 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.4 83.17 0.06 OUTLIER Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.558 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m 65.42 49.62 1.84 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.58 0.352 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.7 t -164.07 113.44 1.21 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.138 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.443 ' O ' HG13 ' A' ' 37' ' ' VAL . 31.2 mt -85.68 139.75 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 36' ' ' ILE . 4.6 m -156.57 154.5 27.04 Favored Pre-proline 0 C--O 1.233 0.185 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.28 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.729 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 44.7 Cg_endo -67.31 166.06 24.73 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.539 2.159 . . . . 0.0 112.255 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.43 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -139.1 -147.02 5.04 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.566 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.7 mp0 -31.96 133.33 0.1 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.356 0.662 . . . . 0.0 112.334 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.62 ' HG3' HG13 ' A' ' 27' ' ' VAL . 1.2 tt0 -136.37 93.97 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.12 168.61 26.02 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.098 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.468 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -86.82 -19.44 28.99 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.573 0.225 . . . . 0.0 110.799 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -89.95 112.14 23.43 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -66.72 -23.1 66.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.768 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.791 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -48.7 -35.04 13.11 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.678 0.275 . . . . 0.0 110.792 179.613 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 -38.78 90.81 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.052 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.583 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 56.9 t80 -70.97 -38.9 72.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.576 0.227 . . . . 0.0 110.926 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.791 HD12 ' HA ' ' A' ' 46' ' ' GLN . 17.0 mt -62.93 -40.28 88.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.795 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -45.9 85.21 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.359 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -31.63 67.89 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.468 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.443 ' HB3' ' CD1' ' A' ' 120' ' ' LEU . 1.8 m -74.01 83.94 1.76 Allowed 'General case' 0 C--O 1.233 0.184 0 CA-C-O 120.971 0.415 . . . . 0.0 111.182 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.2 p -100.29 -176.97 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.075 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.25 18.08 2.31 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.853 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.638 ' O ' HG13 ' A' ' 56' ' ' VAL . 47.9 t0 -144.09 79.59 1.62 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.854 0.359 . . . . 0.0 110.219 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.638 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.59 -175.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.39 -179.417 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.718 ' HD2' HG23 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -171.57 77.2 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.073 0.463 . . . . 0.0 110.671 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -132.38 170.95 14.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.463 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -106.2 174.88 5.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.583 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -151.48 157.76 42.74 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.255 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.402 ' CD2' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -135.3 121.09 19.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.799 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.575 HG22 ' HB2' ' A' ' 26' ' ' TRP . 16.2 t -135.77 127.24 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.102 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.16 118.45 26.58 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.471 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -106.3 154.14 21.18 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.863 0.364 . . . . 0.0 111.662 -179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.232 0.179 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.324 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.742 0.306 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.503 ' HE3' HD23 ' A' ' 129' ' ' LEU . 0.0 OUTLIER -143.19 150.71 39.74 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.098 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.42 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 11.6 m-85 -105.55 116.97 32.84 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.002 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.09 123.62 50.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.822 0.344 . . . . 0.0 111.428 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.442 ' HB3' ' CB ' ' A' ' 111' ' ' GLU . 3.5 tp -98.18 104.65 16.7 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.337 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.464 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 38.6 mm -85.68 100.06 8.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 86.5 m -84.8 108.77 17.64 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.31 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.661 ' CE3' HD11 ' A' ' 120' ' ' LEU . 66.5 t-105 -95.29 138.78 32.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.967 0.413 . . . . 0.0 111.435 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.508 HG23 ' OG ' ' A' ' 115' ' ' SER . 2.7 tt -141.1 88.02 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.831 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.46 123.37 33.13 Favored Glycine 0 C--N 1.336 0.563 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.57 -39.83 0.52 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -178.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.9 m-80 -73.75 42.96 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.226 0.536 . . . . 0.0 111.549 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.718 HG23 ' HD2' ' A' ' 57' ' ' ARG . 8.1 p -96.59 135.61 30.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.766 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 m -71.33 157.87 37.34 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.89 -42.83 87.11 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.987 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mt -58.85 -43.11 90.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.638 0.256 . . . . 0.0 111.045 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.92 -33.78 76.34 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.194 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -52.74 33.57 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.975 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.47 -36.44 78.97 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 179.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -43.28 69.82 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -49.19 -46.83 46.11 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.16 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.62 -45.85 93.61 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.373 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 21.8 m -62.54 -46.57 87.79 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.71 0.29 . . . . 0.0 110.877 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.573 ' HA ' HD12 ' A' ' 100' ' ' LEU . 62.8 m-20 -61.03 -37.29 82.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -57.19 -34.09 68.15 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.709 0.29 . . . . 0.0 110.637 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.7 m -72.66 -43.39 63.23 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.624 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 97' ' ' ASP . 37.9 mt -58.31 -47.13 84.66 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 38.8 t -64.64 -38.28 82.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.873 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -38.18 90.14 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.97 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -63.74 -38.93 92.96 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.758 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 t -81.59 -42.86 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.046 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -108.75 102.72 14.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.904 0.383 . . . . 0.0 110.984 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mp0 -100.93 -28.86 12.53 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.339 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -80.57 78.7 7.28 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.006 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.42 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 26.1 p90 -133.88 160.47 37.57 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.6 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -97.94 -61.89 1.32 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.437 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.87 149.54 33.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.442 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -144.93 129.46 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.673 ' HE1' HD11 ' A' ' 114' ' ' ILE . 10.4 p90 -144.02 161.78 37.89 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.97 0.414 . . . . 0.0 111.261 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.485 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 14.5 p -101.18 140.79 19.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.034 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.673 HD11 ' HE1' ' A' ' 112' ' ' PHE . 15.9 mt -133.63 148.39 30.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.508 ' OG ' HG23 ' A' ' 82' ' ' ILE . 1.7 m -131.16 26.42 4.87 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.228 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.606 ' H ' HG22 ' A' ' 114' ' ' ILE . 24.4 t70 -134.19 138.14 44.92 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.606 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -37.06 80.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.006 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -43.27 99.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -69.61 -31.56 69.75 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.613 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.661 HD11 ' CE3' ' A' ' 81' ' ' TRP . 17.1 mt -62.25 -31.96 72.59 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.969 179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -46.17 127.62 8.83 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -49.8 -41.65 45.06 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.647 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -56.2 -42.7 77.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.96 0.409 . . . . 0.0 110.278 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -64.51 -48.82 73.72 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 31.6 mt -59.26 -45.58 92.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -44.02 72.85 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.861 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.9 t -63.07 -43.16 99.37 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.744 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -52.23 65.5 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.503 HD23 ' HE3' ' A' ' 75' ' ' LYS . 2.4 mp -61.12 -31.88 71.58 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.717 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.954 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.755 0.312 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -129.39 170.13 14.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.151 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -124.48 129.38 73.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.683 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.436 ' HB2' HG12 ' A' ' 37' ' ' VAL . 4.7 m-20 -81.26 112.57 18.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.599 ' HE3' HG22 ' A' ' 104' ' ' VAL . 6.2 mptt -68.55 -40.98 80.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.753 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.52 -47.07 76.84 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.032 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.646 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -68.49 -54.15 18.73 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.266 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 m -52.86 -47.88 67.47 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.433 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -67.46 -38.62 84.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.07 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.34 -50.31 71.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.021 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.642 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.33 -45.52 93.13 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.925 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -55.66 -44.51 77.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -57.44 -42.9 83.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.911 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -39.39 93.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.944 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 13' ' ' ALA . 17.7 t -64.56 -35.15 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.129 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -38.03 63.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.048 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.544 179.486 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.553 ' C ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.977 0.417 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.89 107.07 5.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.948 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 HG23 ' A' ' 62' ' ' VAL . 1.1 pp -112.69 -29.58 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.742 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.419 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.8 p-90 -127.31 160.22 32.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.998 0.427 . . . . 0.0 111.391 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.905 HG13 ' HG2' ' A' ' 41' ' ' GLN . 2.6 t -139.42 149.77 22.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.469 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 60.5 m -89.01 161.92 16.32 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.401 ' N ' HG22 ' A' ' 28' ' ' THR . 15.8 m-85 -149.0 93.45 2.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.676 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 ptmm? -132.38 142.74 49.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -85.57 133.34 34.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.058 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.24 110.14 22.23 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.184 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.87 -71.08 2.79 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.932 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.4 p -162.36 30.52 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.585 0.231 . . . . 0.0 111.204 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 37.4 p -144.33 123.95 13.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.783 0.325 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.3 mp -72.73 130.08 35.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.85 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.436 HG12 ' HB2' ' A' ' 6' ' ' ASP . 10.6 m -151.78 145.7 18.01 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.35 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.646 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 29.2 Cg_exo -62.09 168.35 9.28 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.568 2.179 . . . . 0.0 112.46 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.469 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -140.33 -145.9 4.73 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.598 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.6 mp0 -34.22 137.92 0.1 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.353 0.661 . . . . 0.0 112.582 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.905 ' HG2' HG13 ' A' ' 27' ' ' VAL . 4.9 mt-30 -134.76 96.82 3.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.002 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.13 163.13 25.1 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.437 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.553 ' HB2' ' C ' ' A' ' 23' ' ' ALA . . . -86.4 -22.37 26.62 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.719 -0.241 . . . . 0.0 110.927 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -94.8 113.38 25.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.129 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -64.36 -20.1 65.9 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.627 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.8 OUTLIER -46.46 -38.59 9.37 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.704 0.287 . . . . 0.0 110.746 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -42.01 97.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.208 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.475 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 24.3 t80 -69.07 -39.46 79.09 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.685 0.278 . . . . 0.0 110.713 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.627 HD12 ' HA ' ' A' ' 46' ' ' GLN . 25.7 mt -63.63 -34.93 70.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.067 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.29 -25.02 25.71 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.625 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -85.81 -25.41 26.33 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.596 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.6 p -75.07 66.76 1.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.892 0.377 . . . . 0.0 111.513 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -72.73 149.72 43.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.914 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.419 ' HB2' ' HB2' ' A' ' 84' ' ' GLU . 5.5 p-10 -80.56 56.06 2.5 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.453 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.699 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.0 OUTLIER -161.31 39.74 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.901 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.699 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.97 152.89 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.304 -179.564 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.476 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -112.6 129.71 56.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.407 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 pp -160.47 175.1 13.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.037 0.446 . . . . 0.0 111.782 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.494 ' CD1' HG23 ' A' ' 80' ' ' THR . 34.4 m-85 -111.3 178.83 4.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.924 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.734 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -145.6 159.88 42.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.033 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -149.02 118.66 6.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.835 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.457 HG23 HD12 ' A' ' 25' ' ' ILE . 14.4 p -149.97 139.4 15.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.791 0.329 . . . . 0.0 111.206 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.514 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 5.1 ptm180 -120.94 152.61 38.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.404 ' HD2' HD13 ' A' ' 129' ' ' LEU . 55.0 m-85 -139.19 150.8 45.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.055 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.0 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.651 179.497 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.639 0.257 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmpp? -135.7 160.65 37.86 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.308 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.514 ' CD2' ' HB3' ' A' ' 63' ' ' ARG . 81.8 m-85 -112.02 163.12 14.63 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.1 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.551 ' HB2' HD12 ' A' ' 129' ' ' LEU . . . -150.92 126.58 10.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.354 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 4.6 mp -100.14 112.92 25.24 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.322 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.734 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 16.4 mt -104.11 139.6 24.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.387 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.494 HG23 ' CD1' ' A' ' 59' ' ' PHE . 15.2 m -109.23 125.86 52.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.296 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -110.11 141.79 42.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.962 0.41 . . . . 0.0 111.562 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.455 HG23 HG21 ' A' ' 86' ' ' VAL . 72.4 mt -139.59 101.88 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.888 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -75.03 90.45 0.79 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 113.832 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HB2' ' HB2' ' A' ' 54' ' ' ASP . 0.5 OUTLIER 19.09 -73.15 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 178.369 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.604 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 21.1 m-80 -41.58 -26.46 0.07 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.072 0.549 . . . . 0.0 112.183 -178.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 83' ' ' GLY . 16.6 t -44.62 104.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 m -69.16 173.52 5.53 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.01 0.433 . . . . 0.0 111.909 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.97 -45.32 93.88 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.554 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -41.68 71.25 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.854 0.359 . . . . 0.0 110.65 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.476 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.8 mp0 -65.85 -36.34 83.19 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.542 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -46.8 81.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.485 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.35 98.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.504 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -59.06 -38.6 79.76 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.59 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 28.6 m -63.89 -39.47 94.27 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.719 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -60.89 -46.21 94.99 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.331 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -40.99 98.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.601 0.239 . . . . 0.0 110.649 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' HG23 ' A' ' 101' ' ' VAL . 73.2 m-20 -65.91 -38.0 87.55 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.889 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -56.86 -33.67 67.05 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.783 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.5 m -74.83 -41.39 59.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.432 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.545 ' O ' HG23 ' A' ' 104' ' ' VAL . 25.3 mt -61.76 -46.06 91.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.016 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 97' ' ' ASP . 23.3 t -66.14 -40.87 88.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.769 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -57.2 -42.38 81.15 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -65.32 -41.13 94.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.718 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.599 HG22 ' HE3' ' A' ' 7' ' ' LYS . 38.2 t -70.44 -48.86 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.977 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -113.21 107.27 22.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.891 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -107.77 -22.44 12.47 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.853 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -75.69 79.43 2.65 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.827 0.346 . . . . 0.0 111.379 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.417 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 29.0 p90 -143.37 159.7 41.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.723 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -87.48 -58.86 2.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.162 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.6 pttp -150.18 172.63 15.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.275 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 10.3 pt-20 -153.93 150.44 28.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.226 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.509 ' HE1' HD11 ' A' ' 114' ' ' ILE . 8.8 p90 -160.18 165.99 30.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.229 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.4 p -108.39 145.34 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.251 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.568 HG22 ' H ' ' A' ' 116' ' ' ASP . 40.9 mt -135.17 146.46 30.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.692 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.7 p -138.4 29.03 2.45 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.297 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.568 ' H ' HG22 ' A' ' 114' ' ' ILE . 22.3 t70 -144.0 135.25 25.66 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.663 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -38.39 81.62 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -65.53 -46.76 78.31 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.703 0.287 . . . . 0.0 110.758 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -69.37 -30.33 68.3 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.476 ' HA ' HD23 ' A' ' 120' ' ' LEU . 0.8 OUTLIER -71.76 -23.09 61.53 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.411 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -48.22 138.44 9.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.169 0.509 . . . . 0.0 111.795 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -36.69 34.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.054 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.57 -39.76 71.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.488 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -71.25 -46.3 61.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.087 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mt -61.94 -47.9 91.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.191 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -38.33 90.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.246 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.7 t -67.54 -43.48 80.63 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.554 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -64.52 -45.13 88.56 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.106 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' A' ' 77' ' ' ALA . 0.9 OUTLIER -62.18 -34.1 75.78 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.33 179.906 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.53 0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.387 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.92 0.39 . . . . 0.0 110.778 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -111.24 176.87 4.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.821 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tt -134.22 128.47 52.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.027 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -81.5 94.73 6.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 1.4 mttm -60.99 -45.31 95.3 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.268 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -54.39 -44.99 72.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.094 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.522 ' HB1' HG23 ' A' ' 37' ' ' VAL . . . -73.15 -50.47 22.49 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.365 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 m -56.11 -43.69 78.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.28 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -69.68 -46.47 65.99 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.44 -43.83 62.15 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.69 0.281 . . . . 0.0 111.155 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -73.35 -36.4 66.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.605 ' CE1' HG13 ' A' ' 105' ' ' VAL . 12.5 t80 -58.82 -55.86 29.63 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.897 -179.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -67.53 -31.66 71.91 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.84 -49.77 55.59 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.654 0.264 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.716 HG21 HG11 ' A' ' 27' ' ' VAL . 44.6 t -69.0 -23.79 27.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -52.5 -36.74 55.88 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.233 0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.285 179.273 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.298 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 24' ' ' VAL . 11.2 p -125.71 118.21 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.875 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -119.63 -33.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.475 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.7 p-90 -131.77 157.68 43.19 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.963 0.411 . . . . 0.0 111.041 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.716 HG11 HG21 ' A' ' 17' ' ' VAL . 17.4 m -145.83 151.99 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.52 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.533 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 40.1 m -90.5 162.06 15.22 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.709 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -146.61 91.22 2.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.173 0.511 . . . . 0.0 110.461 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.91 165.54 14.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.912 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.568 ' HB3' HD13 ' A' ' 36' ' ' ILE . 48.8 p90 -103.13 123.18 46.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.06 0.457 . . . . 0.0 111.279 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.33 114.8 24.82 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.12 38.62 59.28 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.094 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.5 p 69.28 22.39 6.67 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.708 0.403 . . . . 0.0 111.758 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.7 p -136.58 130.46 32.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 0.0 111.24 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.568 HD13 ' HB3' ' A' ' 31' ' ' TYR . 23.4 mm -68.93 130.26 33.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.983 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.522 HG23 ' HB1' ' A' ' 9' ' ' ALA . 5.4 p -150.87 138.77 12.4 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.916 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.51 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 49.3 Cg_exo -55.98 162.47 7.1 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.493 2.129 . . . . 0.0 112.579 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.533 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -133.05 -149.29 6.12 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.596 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.49 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.2 mp0 -37.08 137.51 0.34 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.322 0.649 . . . . 0.0 112.605 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' CG ' HG12 ' A' ' 27' ' ' VAL . 30.9 mt-30 -136.91 103.03 5.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.169 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.27 164.52 26.9 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.268 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -82.23 -22.64 35.76 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.675 0.274 . . . . 0.0 110.844 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -94.92 110.51 22.39 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -66.86 -19.07 65.67 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.67 -37.76 29.96 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.687 0.28 . . . . 0.0 110.674 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -36.42 83.93 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.483 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.492 ' CE1' ' HB2' ' A' ' 60' ' ' ALA . 61.4 t80 -67.47 -52.13 42.98 Favored 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.842 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.7 mt -59.09 -35.08 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.188 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.3 -47.03 74.92 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.315 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.73 -42.62 50.12 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.374 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.745 ' SG ' HD11 ' A' ' 58' ' ' LEU . 4.5 m -77.02 80.55 3.55 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 111.15 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.4 p -108.82 173.09 6.47 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.77 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.612 ' HB3' ' HB2' ' A' ' 84' ' ' GLU . 12.4 m-20 -75.2 69.05 2.02 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.029 0.442 . . . . 0.0 111.284 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.679 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.3 t70 -178.55 47.7 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.329 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.679 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -177.26 -175.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.914 -179.21 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.48 113.08 3.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.698 0.285 . . . . 0.0 111.224 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.745 HD11 ' SG ' ' A' ' 52' ' ' CYS . 3.4 pp -160.61 170.91 19.89 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.9 0.381 . . . . 0.0 111.637 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -105.65 179.36 4.29 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.722 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -160.0 172.64 17.17 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.814 0.34 . . . . 0.0 111.576 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.488 ' CE2' HG11 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -148.33 133.91 18.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.183 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.442 HG22 ' HB2' ' A' ' 26' ' ' TRP . 15.6 t -143.74 133.25 20.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.21 112.43 25.1 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.485 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -98.26 146.94 25.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.952 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.1 m . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.763 179.695 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.8 t . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.868 0.366 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.05 129.64 16.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.805 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.442 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 13.2 m-85 -85.5 126.7 34.04 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.595 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.21 129.33 39.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.479 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.435 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -96.44 141.84 29.25 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.218 179.556 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.629 HG23 HD12 ' A' ' 114' ' ' ILE . 27.2 mt -125.35 122.16 62.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.128 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.513 ' HB ' HG12 ' A' ' 113' ' ' VAL . 7.3 m -104.92 105.9 16.15 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.11 179.058 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -88.98 121.93 31.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.93 0.395 . . . . 0.0 111.523 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.659 HD11 HG21 ' A' ' 86' ' ' VAL . 4.2 tt -111.38 100.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.706 178.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.506 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -67.97 83.8 0.17 Allowed Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.825 -0.625 . . . . 0.0 114.109 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.612 ' HB2' ' HB3' ' A' ' 54' ' ' ASP . 2.3 mm-40 19.6 -81.34 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 178.486 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.423 ' OD1' ' HA ' ' A' ' 55' ' ' ASP . 5.6 p30 -66.51 30.83 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -177.076 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.659 HG21 HD11 ' A' ' 82' ' ' ILE . 3.0 m -64.3 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 161.46 0.5 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.92 -48.63 57.4 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.484 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.55 -33.27 72.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.696 0.284 . . . . 0.0 110.947 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -70.88 -44.78 65.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.314 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -57.69 -47.95 80.92 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.813 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.6 -39.3 93.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.892 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.13 -39.42 86.21 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.063 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -40.8 71.11 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.546 0.212 . . . . 0.0 110.656 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.14 -50.27 57.91 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.595 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -45.84 83.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.87 0.335 . . . . 0.0 110.894 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.532 ' HA ' HD12 ' A' ' 100' ' ' LEU . 74.0 m-20 -60.71 -36.95 80.09 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.262 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -59.44 -33.25 71.04 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.577 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.8 m -68.8 -44.53 73.37 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.454 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 97' ' ' ASP . 12.3 mt -61.77 -45.72 92.67 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 97' ' ' ASP . 38.7 t -65.06 -33.1 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.889 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.71 -32.59 73.99 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.19 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.77 -55.06 10.89 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.823 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.558 HG23 HG23 ' A' ' 105' ' ' VAL . 6.9 m -63.28 -33.89 63.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.614 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.605 HG13 ' CE1' ' A' ' 14' ' ' TYR . 42.1 t -108.82 101.46 12.59 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.496 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -104.3 -33.68 8.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.621 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -78.95 73.19 5.49 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.2 p90 -126.5 156.68 40.35 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.972 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.25 -49.07 4.84 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.277 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.13 141.15 6.73 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.022 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.435 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 14.1 pt-20 -135.44 149.99 49.73 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -159.9 159.84 32.85 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.707 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.513 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.7 m -89.43 153.09 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.979 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.629 HD12 HG23 ' A' ' 79' ' ' ILE . 60.8 mt -136.88 131.48 46.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.886 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -125.57 33.02 5.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.257 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.452 ' H ' HG22 ' A' ' 114' ' ' ILE . 9.7 p-10 -166.86 153.53 8.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.088 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.2 ptt85 -68.58 -24.61 64.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.872 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -63.57 -56.94 12.01 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.67 0.271 . . . . 0.0 110.849 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.467 ' HB2' HG23 ' A' ' 114' ' ' ILE . 37.7 mt-10 -72.17 -24.43 61.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.353 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.57 ' HA ' HD13 ' A' ' 114' ' ' ILE . 2.4 tp -74.33 -25.07 59.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.614 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -52.51 130.76 32.68 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.069 0.461 . . . . 0.0 111.069 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.776 ' HA ' HD12 ' A' ' 125' ' ' ILE . 41.4 tt0 -51.1 -40.6 58.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.899 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.04 -41.74 98.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.897 0.38 . . . . 0.0 110.442 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -63.2 -48.72 77.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.089 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 122' ' ' GLU . 6.9 mt -56.65 -48.07 81.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.007 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.79 -44.98 78.28 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.098 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -39.44 91.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.878 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -59.63 -53.31 59.57 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.018 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.7 pp -69.84 -24.79 63.5 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.744 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? . . . . . 0 N--CA 1.464 0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 111.12 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.737 0.303 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -85.25 145.97 27.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -115.76 125.55 72.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 7.6 t0 -81.97 109.36 16.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.555 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -69.1 -36.89 78.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.97 -47.83 60.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.802 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -56.67 -54.1 50.06 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.888 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.4 m -59.74 -39.0 83.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -60.1 -54.36 46.88 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.44 76.91 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.233 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.75 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -61.9 -49.12 77.48 Favored 'General case' 0 C--N 1.334 -0.072 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.19 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -55.15 -46.28 75.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.507 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 66.6 m-20 -65.49 -26.91 68.13 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.437 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 tp -80.55 -38.54 29.39 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.058 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.75 HG23 ' O ' ' A' ' 13' ' ' ALA . 8.4 t -70.33 -38.31 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.94 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 5.5 ptt180 -61.86 -28.19 69.32 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.15 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.3 t70 . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.588 179.663 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.193 0 CA-C-O 121.017 0.436 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.0 t -133.25 119.77 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.076 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.574 HG12 ' HA ' ' A' ' 43' ' ' ALA . 30.4 pt -120.69 -40.21 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.509 ' CZ3' HG23 ' A' ' 28' ' ' THR . 37.1 p-90 -122.91 158.43 30.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.872 0.367 . . . . 0.0 111.477 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 19.4 m -140.55 143.67 28.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.935 179.145 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.509 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 3.2 p -102.28 97.29 7.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.994 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 6.0 m-85 -79.45 114.66 18.56 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.938 0.399 . . . . 0.0 110.611 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.16 162.17 34.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.695 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.427 ' HA ' ' O ' ' A' ' 35' ' ' THR . 38.7 p90 -111.04 121.61 45.79 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.039 0.447 . . . . 0.0 111.579 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.16 107.01 18.9 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.103 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.33 -78.71 1.42 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.278 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.4 m -151.65 33.97 0.55 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.601 0.239 . . . . 0.0 111.211 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.427 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 2.6 t -144.7 123.8 12.87 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 7.0 mt -84.88 126.08 40.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.158 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.493 HG12 ' CB ' ' A' ' 9' ' ' ALA . 5.9 m -148.6 156.91 41.88 Favored Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.519 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.802 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.0 Cg_endo -65.71 156.68 62.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.657 2.238 . . . . 0.0 112.295 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.41 -154.42 7.81 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.327 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.556 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.7 mp0 -27.59 132.69 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.681 0.792 . . . . 0.0 112.16 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.487 ' HG2' HG12 ' A' ' 27' ' ' VAL . 20.7 mt-30 -134.18 97.16 3.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.188 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.72 164.95 22.39 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.571 -0.823 . . . . 0.0 113.263 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.33 -17.28 24.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.743 -0.228 . . . . 0.0 111.055 179.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -92.65 129.49 38.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.673 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.506 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 23.8 t80 -77.89 -15.5 58.97 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -48.27 -41.64 28.41 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.721 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.59 -38.27 80.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.733 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.463 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 4.0 t80 -57.99 -45.78 86.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.08 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 47.7 mt -65.51 -46.18 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.995 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.97 -38.62 91.75 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.95 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 -30.93 58.79 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.73 74.57 3.39 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.808 0.337 . . . . 0.0 111.565 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -100.52 144.38 29.58 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.645 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.541 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.2 p-10 -76.05 64.96 2.0 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 111.642 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.756 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.7 t0 -168.44 44.71 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.97 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.66 -176.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.617 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.516 HH11 HG23 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -140.21 112.86 8.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.447 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.89 139.54 26.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.946 0.403 . . . . 0.0 111.466 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.479 ' CD2' HG22 ' A' ' 80' ' ' THR . 52.5 m-85 -85.69 141.53 29.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.105 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.463 ' HB1' ' CE2' ' A' ' 48' ' ' PHE . . . -160.26 113.33 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.809 0.338 . . . . 0.0 111.202 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.409 ' CB ' ' HA ' ' A' ' 78' ' ' LEU . 16.8 p90 -116.08 156.13 26.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.723 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -137.75 149.81 25.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.085 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -107.75 112.43 25.09 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.705 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -111.58 137.61 49.2 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.0 t . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.511 179.451 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.841 0.353 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -118.41 141.69 48.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.608 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.602 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 0.9 OUTLIER -100.79 138.8 37.36 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.771 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.767 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -147.32 119.82 8.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.329 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 2.3 mp -92.87 118.6 31.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.546 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.92 100.02 9.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.081 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.543 ' OG1' HG22 ' A' ' 113' ' ' VAL . 0.2 OUTLIER -80.06 120.97 24.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.403 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -98.96 130.28 45.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.194 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.492 HG23 ' O ' ' A' ' 82' ' ' ILE . 2.7 tt -129.99 96.43 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.104 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.541 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -69.27 108.79 2.6 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.805 179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' C ' ' H ' ' A' ' 86' ' ' VAL . 3.7 mm-40 -34.39 -38.97 0.07 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.389 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.756 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 5.6 m-80 -73.15 43.29 0.12 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.391 0.615 . . . . 0.0 111.382 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.516 HG23 HH11 ' A' ' 57' ' ' ARG . 8.6 p -100.94 136.02 34.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.347 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 m -66.55 155.09 38.68 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.18 42.89 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.183 -0.532 . . . . 0.0 113.061 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt -56.89 -43.66 81.51 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.631 0.253 . . . . 0.0 110.922 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.59 -39.04 92.44 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.799 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -49.21 69.57 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.099 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.49 95.12 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.947 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -57.5 -41.95 81.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.7 m -59.09 -43.95 91.88 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.842 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.7 67.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.091 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.8 m -67.6 -37.9 83.22 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.565 0.221 . . . . 0.0 110.7 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.571 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 t70 -57.77 -41.95 83.08 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -30.37 68.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.278 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 m -70.79 -42.69 70.01 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.794 0.33 . . . . 0.0 110.747 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 97' ' ' ASP . 11.2 mt -62.92 -50.93 68.89 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.06 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.434 ' HA ' HG12 ' A' ' 104' ' ' VAL . 14.3 p -59.7 -30.2 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.049 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -67.35 -39.52 85.77 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.793 0.33 . . . . 0.0 110.617 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.74 -35.01 79.18 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.994 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.802 HG13 HG23 ' A' ' 105' ' ' VAL . 14.8 p -87.06 -31.5 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.634 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.802 HG23 HG13 ' A' ' 104' ' ' VAL . 40.8 t -113.38 97.71 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.846 0.355 . . . . 0.0 110.894 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -109.45 -34.32 6.56 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.689 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.75 84.1 2.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.987 0.422 . . . . 0.0 110.83 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -138.06 164.95 27.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.806 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.95 -48.05 5.03 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 1.9 ttmt -156.55 139.31 15.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.821 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 9.1 pt-20 -135.86 135.25 39.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -151.56 159.5 44.08 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.104 0.478 . . . . 0.0 111.534 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.543 HG22 ' OG1' ' A' ' 80' ' ' THR . 11.4 t -103.94 139.72 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.373 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 113' ' ' VAL . 47.5 mm -134.86 149.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.069 0.461 . . . . 0.0 111.489 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 8.6 t -119.05 -25.75 6.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.493 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.405 ' HB3' ' HB2' ' A' ' 119' ' ' GLU . 38.1 t70 -88.68 146.22 25.19 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.925 0.393 . . . . 0.0 110.895 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.748 ' HA ' HD12 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -69.37 -29.76 67.61 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.668 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.4 -32.96 43.11 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.243 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.445 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 0.5 OUTLIER -75.4 -29.28 59.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.621 -179.968 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.808 ' O ' HD22 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -95.9 -13.47 23.91 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.763 ' N ' HD13 ' A' ' 120' ' ' LEU . 0.7 OUTLIER -53.74 153.27 4.65 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 121.145 0.498 . . . . 0.0 111.592 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.691 ' HA ' HD12 ' A' ' 125' ' ' ILE . 1.8 tt0 -54.66 -37.54 65.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.895 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -42.1 93.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.84 0.353 . . . . 0.0 110.207 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.445 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 12.2 t80 -70.41 -41.8 72.49 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.0 179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 122' ' ' GLU . 23.8 mt -61.24 -57.58 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.125 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -38.2 74.47 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.415 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.9 t -70.41 -48.64 55.16 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.994 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.14 -44.88 94.29 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.653 0.263 . . . . 0.0 111.074 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.767 HD11 ' CB ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -59.89 -37.38 79.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.577 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.7 tttp . . . . . 0 C--O 1.232 0.176 0 N-CA-C 111.639 0.236 . . . . 0.0 111.639 -179.302 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.819 0.342 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.18 127.71 32.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.517 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -138.82 151.26 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.469 HG12 HG21 ' A' ' 104' ' ' VAL . 0.6 OUTLIER -113.22 127.85 70.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.954 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -80.44 108.91 14.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.52 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.533 ' HE3' HG13 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -65.65 -37.38 86.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.209 -179.806 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -62.76 -54.01 45.61 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.201 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.698 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.97 -51.84 66.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.163 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 m -54.45 -43.04 71.29 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.881 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -67.73 -42.43 81.9 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.799 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.96 -51.95 64.55 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.98 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.541 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -61.54 -42.35 98.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.926 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.439 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.9 t80 -56.32 -45.22 80.43 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.844 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -57.67 -42.9 84.54 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.092 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.437 HD12 HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -63.99 -44.79 91.6 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.888 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 13' ' ' ALA . 39.2 t -62.93 -33.87 63.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -60.12 -34.79 74.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.69 122.04 24.13 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.567 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -103.21 29.44 5.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.898 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -29.51 4.79 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.911 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.56 171.53 8.96 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.924 0.393 . . . . 0.0 111.362 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.47 56.89 3.45 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.045 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.437 HG11 HD12 ' A' ' 16' ' ' LEU . 39.4 t -140.76 122.9 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.683 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -126.18 -39.41 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.836 ' HB2' HG22 ' A' ' 62' ' ' VAL . 35.9 p-90 -117.44 154.88 30.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.548 HG12 ' HG2' ' A' ' 41' ' ' GLN . 16.3 m -141.73 146.68 22.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.081 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.411 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -88.17 168.59 12.63 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.221 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.45 ' HE1' HG23 ' A' ' 27' ' ' VAL . 25.9 m-85 -148.39 100.77 3.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.283 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.48 155.13 50.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.687 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.8 p90 -106.03 133.2 51.13 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.017 0.437 . . . . 0.0 111.498 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -108.8 120.3 42.08 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.193 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.34 -74.56 1.68 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.227 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.6 37.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.779 0.323 . . . . 0.0 111.227 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.1 t -154.22 131.77 11.36 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.812 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.0 mt -78.0 138.65 19.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.604 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.1 p -153.6 140.33 12.9 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.698 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 16.6 Cg_endo -57.12 161.83 10.36 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.603 2.202 . . . . 0.0 112.292 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.403 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.64 -151.26 7.23 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.632 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.0 mp0 -34.73 140.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.619 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.548 ' HG2' HG12 ' A' ' 27' ' ' VAL . 25.8 mt-30 -137.78 97.77 3.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.357 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.79 165.64 25.83 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.598 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.06 -23.14 33.29 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.643 0.258 . . . . 0.0 110.671 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -86.47 106.97 17.85 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.824 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.432 ' HD2' HD11 ' A' ' 49' ' ' ILE . 37.7 t80 -68.76 -21.08 64.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.525 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.818 ' HA ' HD12 ' A' ' 49' ' ' ILE . 14.5 tt0 -48.04 -38.38 17.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.816 0.341 . . . . 0.0 110.675 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.67 -40.62 95.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.23 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -65.52 -43.6 89.55 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.142 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.818 HD12 ' HA ' ' A' ' 46' ' ' GLN . 6.4 mt -59.72 -42.88 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.361 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.11 -37.81 69.43 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.608 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -38.94 67.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.385 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.606 ' SG ' HD11 ' A' ' 58' ' ' LEU . 5.6 m -86.69 80.4 8.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.637 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.52 161.75 13.47 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.451 ' HA ' ' CA ' ' A' ' 83' ' ' GLY . 3.1 p-10 -72.84 69.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 111.218 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.772 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.0 OUTLIER -168.07 41.17 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.427 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.721 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.97 -172.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.587 -179.335 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.549 ' HB3' HG22 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -148.5 122.77 9.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.632 0.253 . . . . 0.0 110.525 179.026 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.606 HD11 ' SG ' ' A' ' 52' ' ' CYS . 3.0 pp -153.84 174.05 15.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.048 0.451 . . . . 0.0 111.673 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.512 ' CD2' HG21 ' A' ' 101' ' ' VAL . 5.5 m-85 -107.46 171.75 7.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.691 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.3 162.33 40.89 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.425 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.413 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.9 t80 -150.15 107.17 3.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.836 HG22 ' HB2' ' A' ' 26' ' ' TRP . 11.9 t -126.18 136.18 61.58 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.028 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -109.84 136.51 49.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.605 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -121.8 144.82 48.59 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.347 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.04 118.02 35.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.97 91.12 3.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.678 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.478 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.3 158.91 30.33 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.593 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -159.84 79.78 0.7 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.916 0.389 . . . . 0.0 111.201 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.02 34.41 2.01 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.123 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -41.54 0.16 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.665 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 t -158.5 82.17 0.82 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.478 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 4.5 mtmt -79.81 110.29 15.03 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.726 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 155.21 44.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.367 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.97 169.2 8.57 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.114 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 136.93 11.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.738 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.758 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 50.4 m-85 -84.12 152.64 24.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.427 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -151.29 116.11 5.2 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.81 110.38 22.76 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.489 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.609 HG23 HD12 ' A' ' 114' ' ' ILE . 3.6 mp -104.79 126.24 59.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.329 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.9 106.9 16.64 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.35 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.422 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 64.6 t-105 -91.88 132.95 36.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.25 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.537 HG21 HG21 ' A' ' 94' ' ' THR . 5.6 pt -138.52 84.76 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.023 0.44 . . . . 0.0 111.517 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.822 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -59.12 130.93 51.52 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.974 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 86' ' ' VAL . 12.5 mt-10 -30.35 -30.91 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.772 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -75.28 36.64 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.565 0.62 . . . . 0.0 111.719 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.822 HG23 ' O ' ' A' ' 83' ' ' GLY . 98.1 t -88.61 107.46 17.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.293 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -65.26 165.3 11.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.806 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.38 -47.47 50.71 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.918 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -42.63 99.13 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.598 0.237 . . . . 0.0 110.981 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.534 ' HB3' HG13 ' A' ' 86' ' ' VAL . 2.2 mp0 -70.67 -35.1 72.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.073 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -57.08 -53.69 55.19 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.606 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.87 73.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -61.01 -36.69 80.17 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.102 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.537 HG21 HG21 ' A' ' 82' ' ' ILE . 6.6 m -55.64 -52.3 64.29 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.44 0.162 . . . . 0.0 111.006 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.63 -43.89 98.67 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.339 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.4 m -63.35 -47.41 82.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.77 0.319 . . . . 0.0 110.642 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.58 -37.47 81.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.272 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -32.23 70.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.754 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.0 m -72.35 -41.55 66.33 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.461 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.684 ' O ' HG23 ' A' ' 104' ' ' VAL . 40.7 mt -60.13 -50.19 74.67 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.512 HG21 ' CD2' ' A' ' 59' ' ' PHE . 26.4 t -64.33 -36.81 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.0 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.17 -44.82 71.82 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -38.52 70.42 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.749 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 100' ' ' LEU . 59.6 t -58.84 -45.96 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.799 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.439 HG13 ' HE2' ' A' ' 14' ' ' TYR . 39.7 t -96.21 96.18 5.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.62 -33.18 53.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.424 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -111.13 95.97 5.86 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -126.04 178.36 5.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.111 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.758 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -121.19 -54.9 1.99 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.214 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.447 ' HB2' HD23 ' A' ' 129' ' ' LEU . 7.0 mttm -151.05 132.04 14.26 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.801 0.334 . . . . 0.0 111.452 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -136.6 125.24 23.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.508 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -152.17 161.95 41.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.009 0.433 . . . . 0.0 111.436 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 22.8 t -93.35 149.25 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.617 HD13 ' HA ' ' A' ' 120' ' ' LEU . 42.7 mt -137.19 140.58 42.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.71 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 18.1 p -128.34 23.53 5.95 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.358 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.596 ' H ' HG22 ' A' ' 114' ' ' ILE . 37.0 t70 -143.77 137.58 28.17 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.7 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.529 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 6.6 ttp180 -61.74 -37.02 82.68 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.329 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -70.74 -33.64 71.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.404 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 8.6 mt-10 -76.8 -30.61 56.5 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.078 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.617 ' HA ' HD13 ' A' ' 114' ' ' ILE . 2.6 pp -88.58 -7.41 56.49 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.207 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -54.5 152.64 6.46 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.171 0.51 . . . . 0.0 110.76 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -55.45 -42.28 74.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.27 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.452 ' HB2' ' HB ' ' A' ' 141' ' ' THR . 0.4 OUTLIER -63.99 -31.0 72.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.697 -179.372 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.427 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 11.8 t80 -75.5 -46.21 33.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.97 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.472 HD11 ' O ' ' A' ' 120' ' ' LEU . 22.9 mt -58.96 -53.58 45.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -58.59 -35.27 72.14 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.5 t -60.47 -48.0 83.69 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.655 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.53 -41.72 95.03 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.93 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 77' ' ' ALA . 18.0 mt -68.39 -43.42 77.31 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -64.11 -48.16 77.19 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.385 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -72.05 -65.29 0.79 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.959 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 52.8 38.16 25.85 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.792 0.33 . . . . 0.0 111.424 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 128.69 55.52 0.11 Allowed Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.419 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -103.8 -168.35 25.3 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.448 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -101.24 34.29 2.6 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.71 0.29 . . . . 0.0 111.392 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 48.61 42.1 18.6 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.553 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -92.65 54.31 2.22 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.985 0.421 . . . . 0.0 111.161 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -118.75 153.92 33.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -147.62 -56.49 0.24 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.079 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -107.88 16.63 23.33 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.916 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' THR . . . . . 0.452 ' HB ' ' HB2' ' A' ' 123' ' ' ASN . 0.0 OUTLIER 52.58 44.57 29.91 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.353 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.626 0.251 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.415 HG21 ' HG3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER -99.2 112.46 24.61 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -111.87 145.13 40.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.139 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 16.2 tt -110.59 127.59 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.78 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 6.5 t0 -87.31 115.62 24.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.603 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -70.77 -45.29 65.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.287 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -59.46 -42.77 92.77 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.242 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.777 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -67.03 -56.09 11.57 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.893 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.5 t -55.47 -42.92 74.99 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.877 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -44.89 93.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.863 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.16 -46.9 69.08 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.037 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.435 ' HB1' HG11 ' A' ' 27' ' ' VAL . . . -68.15 -32.35 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.309 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.418 ' HE2' HG13 ' A' ' 105' ' ' VAL . 2.2 t80 -61.03 -56.43 21.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.649 0.261 . . . . 0.0 111.473 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -68.69 -24.55 64.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.21 -39.58 22.89 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.568 0.223 . . . . 0.0 111.53 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.93 -32.94 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.419 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -67.81 -23.97 65.24 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.203 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -65.21 98.74 0.34 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -27.84 67.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.092 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -57.41 -34.02 67.49 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.763 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -94.89 156.93 16.13 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.491 ' C ' ' HB2' ' A' ' 43' ' ' ALA . . . -75.95 61.66 1.52 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.507 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.545 HG13 ' HB3' ' A' ' 41' ' ' GLN . 45.8 t -137.35 112.84 10.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.637 HD12 HG13 ' A' ' 62' ' ' VAL . 1.5 pp -125.36 -31.54 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.976 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.5 ' CZ3' HG23 ' A' ' 28' ' ' THR . 34.6 p-90 -122.91 159.49 28.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.43 . . . . 0.0 111.421 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.709 HG12 ' HG2' ' A' ' 41' ' ' GLN . 6.5 m -138.08 144.86 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.176 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.5 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 1.5 p -103.75 97.06 7.13 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.558 -179.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 10.8 m-85 -78.62 110.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 0.0 110.948 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.439 ' HE2' ' HA3' ' A' ' 39' ' ' GLY . 1.6 pttt -126.63 175.34 8.02 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.311 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -82.13 128.27 33.97 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.6 ' HB2' HG22 ' A' ' 37' ' ' VAL . 0.8 OUTLIER -96.37 69.01 2.61 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.083 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -13.77 10.13 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.284 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 169.51 -31.9 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.956 0.378 . . . . 0.0 111.104 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -91.88 177.18 6.26 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.663 0.268 . . . . 0.0 110.854 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.07 123.01 68.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.018 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 32' ' ' ASP . 28.8 m -147.26 154.65 46.1 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.192 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.777 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.1 Cg_endo -66.27 161.37 40.83 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.519 2.146 . . . . 0.0 112.174 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.439 ' HA3' ' HE2' ' A' ' 30' ' ' LYS . . . -132.7 -151.07 6.59 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.092 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.6 mp0 -27.46 133.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.32 0.648 . . . . 0.0 111.993 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.709 ' HG2' HG12 ' A' ' 27' ' ' VAL . 35.2 mt-30 -128.74 99.05 5.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.351 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.86 23.95 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.402 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.491 ' HB2' ' C ' ' A' ' 23' ' ' ALA . . . -86.74 -25.0 24.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 110.837 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.44 118.53 30.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.508 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.525 ' CD2' HG23 ' A' ' 49' ' ' ILE . 13.1 t80 -66.83 -19.6 65.77 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.646 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.02 -40.24 10.28 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.069 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -37.19 86.54 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.272 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -70.37 -49.76 45.83 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.313 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.525 HG23 ' CD2' ' A' ' 45' ' ' TYR . 20.2 pt -59.42 -23.51 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.556 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.27 -27.44 18.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.304 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.07 -33.91 33.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.747 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.4 p -66.29 81.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.037 0.446 . . . . 0.0 111.844 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -90.82 153.16 20.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -88.24 62.17 6.59 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.997 0.427 . . . . 0.0 111.299 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.743 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.1 t0 -158.85 29.94 0.22 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.231 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.743 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.87 158.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.846 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -106.44 143.7 34.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.465 179.156 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 pp -160.04 147.37 16.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.458 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -86.04 169.57 13.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.945 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 154.86 36.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.467 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -149.71 114.52 5.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.541 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.637 HG13 HD12 ' A' ' 25' ' ' ILE . 16.5 t -124.92 144.18 35.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.152 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 143.91 45.76 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.971 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -128.56 158.16 39.22 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.001 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.6 t -134.13 94.84 3.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.586 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.4 p -90.28 108.84 20.01 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.831 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.644 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -155.53 138.74 6.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.975 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.466 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.5 OUTLIER -87.13 -178.12 6.17 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.601 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.77 17.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.466 ' H ' ' C ' ' A' ' 68' ' ' ASP . 22.9 ptm -123.21 -32.88 3.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.418 0.287 . . . . 0.0 111.549 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.88 171.76 19.86 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 120.636 0.255 . . . . 0.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.644 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -145.59 143.89 30.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.413 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.05 176.15 5.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.732 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -142.3 126.04 17.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.695 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm -119.49 162.97 17.99 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 53.0 m-85 -132.53 131.67 41.82 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.816 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.47 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -130.24 121.05 25.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.169 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.36 100.14 10.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.257 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.755 HG21 HD12 ' A' ' 114' ' ' ILE . 12.3 mt -100.91 145.38 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.162 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.932 ' HB ' HG12 ' A' ' 113' ' ' VAL . 16.1 m -117.18 120.73 39.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.231 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.525 ' CE3' HD11 ' A' ' 120' ' ' LEU . 72.6 t-105 -92.09 143.81 26.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.329 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.534 HG23 HG11 ' A' ' 86' ' ' VAL . 56.8 mt -139.56 111.1 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.129 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -89.44 107.4 3.4 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 113.376 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 7.56 -68.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 178.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.568 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 9.5 m-80 -42.38 -26.25 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.943 0.497 . . . . 0.0 111.925 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.798 HG13 ' HB3' ' A' ' 90' ' ' GLN . 74.3 t -54.06 100.19 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.291 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.7 p -75.33 -178.41 3.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.57 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.44 -47.72 62.06 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.184 -0.531 . . . . 0.0 112.639 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.1 mt -59.02 -46.59 87.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.714 0.293 . . . . 0.0 110.621 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.798 ' HB3' HG13 ' A' ' 86' ' ' VAL . 5.8 mp0 -65.59 -38.56 89.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.521 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -63.49 -39.61 94.89 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 -34.27 77.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.071 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.415 ' HG3' HG21 ' A' ' 3' ' ' THR . 0.1 OUTLIER -59.69 -46.27 89.59 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -34.51 73.33 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.76 -51.68 54.0 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.966 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 m -64.34 -37.56 87.94 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.711 0.291 . . . . 0.0 110.665 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.732 ' HA ' HD12 ' A' ' 100' ' ' LEU . 9.1 m-20 -60.56 -40.93 93.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.69 -32.11 68.84 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.574 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.8 m -69.42 -44.13 71.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.771 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.732 HD12 ' HA ' ' A' ' 97' ' ' ASP . 7.5 mt -62.07 -46.64 88.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.855 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 97' ' ' ASP . 21.7 t -67.17 -33.36 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.165 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 ttpp -70.13 -38.39 75.53 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.955 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -30.67 69.22 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.904 HG13 HG23 ' A' ' 105' ' ' VAL . 13.9 p -92.7 -32.03 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.233 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.904 HG23 HG13 ' A' ' 104' ' ' VAL . 26.0 t -122.02 109.41 24.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.925 0.393 . . . . 0.0 110.867 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -18.53 13.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.762 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.04 79.66 2.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.764 0.316 . . . . 0.0 111.024 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.428 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.0 p90 -140.73 159.9 41.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.59 -55.17 2.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.45 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.7 150.05 51.52 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.777 0.322 . . . . 0.0 111.274 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.22 124.62 15.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.078 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.689 ' HE2' HD11 ' A' ' 114' ' ' ILE . 33.2 p90 -160.31 153.44 21.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.897 0.38 . . . . 0.0 111.366 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.932 HG12 ' HB ' ' A' ' 80' ' ' THR . 6.2 m -90.99 153.8 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.975 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.755 HD12 HG21 ' A' ' 79' ' ' ILE . 60.1 mt -139.56 142.18 33.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.928 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.21 25.87 3.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.383 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.539 ' H ' HG22 ' A' ' 114' ' ' ILE . 13.9 t70 -139.14 139.39 37.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.888 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -67.21 -36.78 82.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.999 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -66.2 -45.37 81.01 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.548 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 -25.12 64.8 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.049 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.525 HD11 ' CE3' ' A' ' 81' ' ' TRP . 5.9 mt -73.56 -31.37 63.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.981 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -49.45 136.63 16.07 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.008 0.433 . . . . 0.0 111.385 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -31.08 7.28 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.143 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -59.74 -41.84 91.83 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 120.932 0.396 . . . . 0.0 110.261 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -76.78 -43.46 36.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.111 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.619 HG22 HD13 ' A' ' 129' ' ' LEU . 38.2 mm -60.53 -47.33 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.255 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -62.56 -32.84 73.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.3 t -68.91 -47.58 65.42 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.604 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -66.16 -39.94 90.17 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.135 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.619 HD13 HG22 ' A' ' 125' ' ' ILE . 0.6 OUTLIER -61.57 -23.46 65.99 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.663 -179.937 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -56.93 -34.25 67.81 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.612 0.244 . . . . 0.0 111.26 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.39 -31.78 67.98 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.174 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.25 32.08 2.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.34 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -120.99 23.19 7.82 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.688 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.61 95.05 0.94 Allowed Glycine 0 C--N 1.335 0.513 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.195 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -171.65 26.46 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -164.68 26.41 0.06 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.737 0.303 . . . . 0.0 111.191 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.6 -30.1 65.43 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.715 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.78 144.17 39.41 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.944 0.402 . . . . 0.0 111.377 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -166.11 -47.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.216 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -92.98 14.09 18.7 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.802 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 4.6 m 61.85 92.99 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.307 179.958 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.682 0.277 . . . . 0.0 111.506 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 m -61.85 128.48 36.41 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.849 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -112.6 147.37 36.82 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.02 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.472 HD12 HG21 ' A' ' 36' ' ' ILE . 2.3 tt -109.42 126.98 66.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.52 107.96 13.76 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.509 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 2.2 mttt -63.03 -38.57 91.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.289 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.6 -52.44 65.41 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.143 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.746 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.14 -50.88 68.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.3 m -54.52 -43.43 71.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.117 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -61.35 -45.3 94.98 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.681 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.65 73.62 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.656 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.54 -52.01 67.01 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.963 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.43 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.9 t80 -56.23 -45.91 79.75 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.89 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -57.23 -46.22 83.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -43.35 83.99 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.062 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.656 HG23 ' O ' ' A' ' 13' ' ' ALA . 55.1 t -65.84 -33.55 64.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.984 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -59.19 -38.91 81.01 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -80.4 127.99 33.04 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.309 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.7 40.09 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 45.98 0.73 Allowed Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.022 -0.608 . . . . 0.0 112.951 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.573 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.0 OUTLIER -138.07 24.27 2.79 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 54.41 28.67 9.82 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.643 HG11 ' HB3' ' A' ' 41' ' ' GLN . 48.8 t -133.85 125.74 49.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-O 120.579 0.228 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.444 HD11 ' HD1' ' A' ' 26' ' ' TRP . 1.2 pp -113.07 -31.0 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.823 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.639 ' HB2' HG22 ' A' ' 62' ' ' VAL . 37.0 p-90 -127.86 157.66 39.88 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 110.968 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.699 HG12 ' HG2' ' A' ' 41' ' ' GLN . 10.2 m -140.46 144.78 26.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.723 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.421 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 98.0 m -88.28 161.42 17.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.696 0.284 . . . . 0.0 110.908 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -144.64 97.17 2.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.99 0.424 . . . . 0.0 110.518 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.86 -178.63 4.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.97 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.596 ' HB3' HD13 ' A' ' 36' ' ' ILE . 39.4 p90 -112.97 118.27 34.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.001 0.429 . . . . 0.0 111.275 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.75 111.45 23.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.192 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.7 -75.41 1.84 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.237 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.27 35.41 0.17 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 111.069 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 t -155.68 140.73 17.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.596 HD13 ' HB3' ' A' ' 31' ' ' TYR . 33.5 mm -70.61 137.35 24.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.811 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.606 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.6 p -160.27 139.87 8.2 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.996 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.746 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 12.9 Cg_endo -55.28 152.7 30.53 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.822 2.348 . . . . 0.0 112.16 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.421 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -124.62 -150.35 7.83 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.746 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 17.6 mp0 -32.05 136.25 0.07 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.651 0.781 . . . . 0.0 112.727 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.699 ' HG2' HG12 ' A' ' 27' ' ' VAL . 45.2 mt-30 -136.85 97.49 3.54 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.328 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.22 168.94 25.58 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.773 -0.727 . . . . 0.0 113.461 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.77 -20.07 23.97 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.708 0.289 . . . . 0.0 110.618 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -93.24 128.62 39.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.541 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -76.83 -21.29 55.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.787 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -38.55 19.92 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.962 0.41 . . . . 0.0 110.489 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -37.5 87.44 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.401 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.483 ' HE2' HD22 ' A' ' 120' ' ' LEU . 46.1 t80 -69.33 -48.78 60.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.22 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 52.0 mt -62.1 -38.98 82.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.357 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.99 -41.07 87.38 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.673 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -34.01 46.41 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.69 84.95 3.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.9 p -85.85 169.62 13.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.188 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -83.79 17.87 2.17 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.777 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -134.27 65.08 1.58 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.787 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 170.25 143.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.625 -179.608 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.593 ' HB3' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -112.79 125.84 54.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.631 178.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 pp -153.81 171.93 18.14 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.019 0.437 . . . . 0.0 111.503 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -104.9 167.16 9.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.54 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -153.8 155.32 35.61 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.641 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.494 ' CE1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -145.55 119.16 9.13 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.639 HG22 ' HB2' ' A' ' 26' ' ' TRP . 22.1 t -128.35 144.37 38.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.951 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 mmt85 -100.44 105.33 16.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.613 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -90.17 153.63 20.37 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.86 102.51 5.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.273 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.514 HG21 ' HG2' ' A' ' 130' ' ' LYS . 0.9 OUTLIER -97.96 96.91 8.49 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.858 -179.562 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.568 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.01 154.5 25.54 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.472 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.22 79.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.31 38.36 2.44 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.337 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -156.94 -37.69 0.08 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.313 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.0 p -157.74 79.04 0.86 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.918 0.39 . . . . 0.0 110.556 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.568 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -87.08 106.55 17.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.716 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 37.2 ttp180 -143.52 136.3 27.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p -87.38 161.03 18.13 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.434 ' HE2' HD23 ' A' ' 129' ' ' LEU . 9.3 mtpt -143.17 149.89 38.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.02 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -106.39 118.83 37.66 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.417 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -129.53 119.23 23.35 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.251 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.51 ' HG ' ' HB3' ' A' ' 111' ' ' GLU . 0.5 OUTLIER -99.34 124.61 44.59 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.09 179.444 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.565 HG21 ' CD1' ' A' ' 114' ' ' ILE . 1.1 mt -116.43 145.58 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.687 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -112.5 114.34 26.97 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.288 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.411 ' CD2' HD11 ' A' ' 120' ' ' LEU . 48.1 t-105 -91.99 135.67 33.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.533 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mt -138.2 89.91 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.151 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.685 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -61.09 116.83 9.92 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.975 -0.631 . . . . 0.0 111.664 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.8 mt-10 -29.21 -40.31 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.4 m-80 -72.27 41.55 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.115 0.483 . . . . 0.0 111.985 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.685 HG23 ' O ' ' A' ' 83' ' ' GLY . 20.1 t -107.71 122.76 62.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.11 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -72.4 164.45 26.33 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.85 0.357 . . . . 0.0 111.39 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.17 -44.32 57.2 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.022 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.33 -47.88 77.85 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.638 0.256 . . . . 0.0 110.896 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.453 ' CB ' HG13 ' A' ' 86' ' ' VAL . 0.7 OUTLIER -68.21 -34.97 77.24 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.49 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -60.51 -45.18 94.73 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.89 87.59 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.776 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -53.25 -40.72 64.81 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.857 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 m -56.49 -41.92 77.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.173 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.95 -45.02 97.0 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.624 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -46.35 55.16 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.514 0.197 . . . . 0.0 111.251 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.809 ' HA ' HD12 ' A' ' 100' ' ' LEU . 34.0 m-20 -64.11 -35.06 79.52 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.448 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -55.85 -36.66 67.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.877 0.37 . . . . 0.0 110.259 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.5 m -72.95 -42.15 63.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.279 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.809 HD12 ' HA ' ' A' ' 97' ' ' ASP . 9.7 mt -59.78 -48.88 79.89 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.99 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 97' ' ' ASP . 46.9 t -62.38 -46.29 96.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -36.9 76.64 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.947 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.38 -35.83 81.7 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.089 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 100' ' ' LEU . 40.4 t -76.77 -42.92 33.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.43 HG13 ' HE2' ' A' ' 14' ' ' TYR . 36.9 t -119.97 108.56 23.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.032 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.73 -25.38 12.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.586 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -78.89 85.35 4.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.834 0.35 . . . . 0.0 110.782 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -133.24 177.41 7.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.002 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.91 -57.6 2.09 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.501 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.413 ' HE3' ' HG3' ' A' ' 128' ' ' GLU . 35.2 tttm -135.88 140.35 44.05 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.219 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.51 ' HB3' ' HG ' ' A' ' 78' ' ' LEU . 9.1 pt-20 -141.28 132.36 26.26 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.873 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.583 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 11.8 p90 -154.24 168.23 27.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.968 0.413 . . . . 0.0 111.63 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 23.0 t -106.9 145.29 14.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.028 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.593 HG23 ' HB2' ' A' ' 119' ' ' GLU . 84.5 mt -124.65 134.28 67.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.594 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -122.2 17.96 10.72 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.723 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.449 ' H ' HG22 ' A' ' 114' ' ' ILE . 6.8 p-10 -155.3 145.5 21.8 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 111.022 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -61.05 -28.68 69.24 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.497 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -59.93 -46.77 88.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.612 0.244 . . . . 0.0 110.561 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.593 ' HB2' HG23 ' A' ' 114' ' ' ILE . 5.7 mt-10 -66.63 -41.83 87.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.456 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.483 HD22 ' HE2' ' A' ' 48' ' ' PHE . 12.3 mt -53.36 -35.44 60.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.586 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -42.83 126.56 3.8 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.567 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.77 -37.89 44.88 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.007 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -59.24 -46.4 88.58 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.803 0.335 . . . . 0.0 110.619 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -61.41 -50.45 72.81 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.906 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.583 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 32.6 mm -56.93 -45.76 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -48.32 74.53 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.348 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -62.87 -42.43 99.75 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.857 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.413 ' HG3' ' HE3' ' A' ' 110' ' ' LYS . 2.0 tp10 -58.0 -50.91 71.8 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.018 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -65.25 -37.74 88.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.687 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.514 ' HG2' HG21 ' A' ' 66' ' ' THR . 0.0 OUTLIER -69.73 -36.37 75.8 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.666 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -56.53 -42.1 77.9 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.206 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -113.65 87.83 2.7 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 110.369 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.6 60.86 3.66 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.705 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 175.43 -136.55 3.42 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.819 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -103.29 36.77 2.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.781 0.324 . . . . 0.0 111.451 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 51.15 46.87 25.83 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.482 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -70.91 -36.12 72.57 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.905 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.42 147.73 39.71 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.034 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -149.99 -37.9 0.15 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.121 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.99 14.72 5.75 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.008 0.432 . . . . 0.0 111.347 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 12.6 p -135.57 60.93 1.67 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.559 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.302 -179.966 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.011 0.434 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.9 p -120.35 130.29 54.35 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.56 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -119.57 149.11 42.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.097 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.567 ' HB ' HD12 ' A' ' 36' ' ' ILE . 17.1 tt -132.5 131.0 60.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.84 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.07 105.59 13.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.878 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -60.27 -41.47 93.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -62.42 -43.6 98.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.757 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -64.88 -57.34 9.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.091 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 t -54.33 -43.58 71.34 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.871 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.95 -45.18 94.81 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.713 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.68 -50.36 68.42 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 -50.78 72.68 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.627 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -55.94 -43.14 77.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.037 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.469 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 68.0 m-20 -64.55 -33.79 76.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.793 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -70.63 -46.81 62.63 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.701 0.286 . . . . 0.0 111.15 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 t -68.34 -38.69 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.449 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 9.6 ptm180 -67.52 -23.9 65.5 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -74.71 68.26 1.67 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.939 0.399 . . . . 0.0 111.291 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.51 19.67 1.79 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.697 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 52.82 67.13 2.26 Favored Glycine 0 C--N 1.339 0.725 0 C-N-CA 121.081 -0.581 . . . . 0.0 112.56 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 t -64.7 85.03 0.04 OUTLIER 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.717 0.294 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 57.81 27.3 14.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.716 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.592 HG11 ' HB3' ' A' ' 41' ' ' GLN . 67.7 t -143.22 117.8 4.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.493 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -108.11 -29.4 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.444 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.638 ' CB ' HG22 ' A' ' 62' ' ' VAL . 42.5 p-90 -129.78 159.62 35.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.966 0.412 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -144.89 150.51 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.908 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.473 HG23 ' HE1' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -91.06 162.57 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.027 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -148.18 101.6 3.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 pttt -132.23 159.71 38.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 35' ' ' THR . 54.3 p90 -116.01 131.79 56.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.74 103.04 14.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.849 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.84 -73.27 2.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.758 . . . . 0.0 111.734 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -155.45 32.81 0.37 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.724 0.297 . . . . 0.0 111.464 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 0.7 OUTLIER -140.5 117.56 11.19 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.567 HD12 ' HB ' ' A' ' 5' ' ' ILE . 11.2 mt -77.35 133.45 30.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.245 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.546 HG23 ' HB1' ' A' ' 9' ' ' ALA . 11.3 p -151.2 137.72 11.48 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.757 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 19.5 Cg_endo -58.33 158.12 23.77 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.567 2.178 . . . . 0.0 112.639 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.441 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -127.12 -152.17 7.92 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.629 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 10.0 mp0 -35.48 140.81 0.09 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.536 0.734 . . . . 0.0 112.515 -179.175 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.592 ' HB3' HG11 ' A' ' 24' ' ' VAL . 30.1 mt-30 -139.03 98.2 3.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.518 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.56 167.56 24.74 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.26 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.493 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -85.41 -20.14 30.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.696 -0.252 . . . . 0.0 110.972 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -93.05 107.58 19.34 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.457 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.94 -21.17 65.11 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -46.34 -39.7 10.67 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.776 0.322 . . . . 0.0 110.631 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -42.55 94.94 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.409 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.705 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 40.0 t80 -68.12 -42.41 80.25 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.878 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.01 -35.13 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.207 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.36 -37.25 25.91 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.694 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.98 -42.55 57.37 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -72.66 84.17 1.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.111 0.481 . . . . 0.0 111.049 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.05 164.48 22.44 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.563 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.4 38.5 0.83 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.777 0.323 . . . . 0.0 111.793 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.757 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -139.47 45.28 1.95 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.922 0.391 . . . . 0.0 111.336 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.48 157.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.812 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.31 134.91 45.91 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.325 179.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.9 mt -147.22 170.42 17.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.063 0.459 . . . . 0.0 111.965 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -119.68 160.5 22.41 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.118 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.705 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -155.81 153.44 29.79 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.897 0.379 . . . . 0.0 111.63 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -139.38 122.62 16.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.578 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.638 HG22 ' CB ' ' A' ' 26' ' ' TRP . 11.5 t -130.53 142.38 43.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.91 0.386 . . . . 0.0 111.628 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -101.92 118.47 36.99 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.717 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -102.15 165.1 11.33 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.98 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.9 m -148.0 112.11 5.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.603 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 45.4 p -99.59 117.07 33.16 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.2 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.513 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.16 157.58 28.91 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.614 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.95 79.12 1.46 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.805 0.336 . . . . 0.0 111.211 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 31.39 49.85 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.8 ptm -177.31 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.637 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.9 p -148.23 91.11 1.87 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.913 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.513 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -112.29 122.36 47.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.716 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.69 135.86 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.985 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 149.78 30.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.256 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -144.18 162.71 35.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.602 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 8.2 m-85 -106.35 153.85 21.62 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.795 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.626 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -154.65 125.94 7.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.633 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.3 tt -92.66 127.33 38.12 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.345 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.428 HD13 HD13 ' A' ' 125' ' ' ILE . 29.5 mt -122.02 107.94 20.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.603 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.413 ' HB ' HG22 ' A' ' 113' ' ' VAL . 7.2 m -97.33 132.01 43.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.007 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -114.13 141.84 46.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.871 0.367 . . . . 0.0 111.304 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.6 mt -137.27 104.11 3.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.42 124.12 6.37 Favored Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.372 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -27.61 -51.38 0.07 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.722 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 12.9 m-80 -71.41 49.07 0.15 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -178.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 86' ' ' VAL . 7.1 p -112.39 115.4 49.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.389 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.62 160.06 28.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.051 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.83 -44.45 61.09 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.708 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.25 -45.29 88.08 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.79 0.328 . . . . 0.0 110.795 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.45 -44.1 79.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.686 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -59.09 -46.22 88.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.637 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.04 88.37 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.937 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.83 -44.09 81.71 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.764 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.429 ' O ' ' HB2' ' A' ' 98' ' ' LYS . 9.5 m -50.18 -40.05 45.73 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.662 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.83 -46.85 80.16 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.793 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.97 -44.93 79.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.065 0.433 . . . . 0.0 111.114 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -62.33 -36.25 81.59 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.875 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -58.06 -34.48 70.16 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.9 m -71.0 -43.29 68.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.705 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 83.4 mt -59.57 -50.75 72.69 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.128 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.14 -31.66 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.954 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.9 -32.61 72.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.105 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -48.67 62.97 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.457 HG23 HG23 ' A' ' 105' ' ' VAL . 6.7 m -71.19 -28.67 33.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.457 HG23 HG23 ' A' ' 104' ' ' VAL . 56.1 t -101.22 102.05 12.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -99.48 -32.03 11.33 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.456 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -85.9 86.12 7.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.818 0.342 . . . . 0.0 111.343 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.468 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 p90 -140.25 158.01 44.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.702 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -100.83 -59.6 1.67 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.492 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 151.57 47.49 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.283 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -139.69 135.83 33.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.998 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -160.14 165.62 31.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.03 0.443 . . . . 0.0 111.271 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.413 HG22 ' HB ' ' A' ' 80' ' ' THR . 20.2 t -111.24 139.03 37.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.521 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.548 HG22 ' H ' ' A' ' 116' ' ' ASP . 49.2 mt -124.3 142.41 41.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.9 p -135.12 26.5 3.54 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.362 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.548 ' H ' HG22 ' A' ' 114' ' ' ILE . 34.6 t70 -138.09 138.05 38.34 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.417 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -60.5 -35.15 75.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.684 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.66 -46.9 71.08 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.535 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 1.7 mp0 -69.39 -28.95 66.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.843 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.461 ' O ' HD11 ' A' ' 125' ' ' ILE . 0.4 OUTLIER -67.01 -30.61 70.76 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.728 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -52.17 132.12 33.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.684 ' HA ' HD12 ' A' ' 125' ' ' ILE . 2.7 tp10 -52.44 -35.07 51.34 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.991 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -61.67 -38.93 89.59 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.868 0.366 . . . . 0.0 110.607 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.535 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 7.9 t80 -68.82 -51.58 39.22 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.684 HD12 ' HA ' ' A' ' 122' ' ' GLU . 5.1 mt -54.68 -40.67 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.964 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -51.26 -41.9 60.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.006 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.7 t -70.88 -42.52 69.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -56.02 -34.65 66.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.711 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.626 HD11 ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -64.99 -50.27 66.99 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.556 0.217 . . . . 0.0 111.408 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -71.85 -40.97 68.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.283 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -70.98 -38.19 72.72 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.432 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 57.47 49.8 12.27 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 107.49 -64.71 0.26 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.808 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.42 103.42 0.2 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.33 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -93.18 19.75 7.69 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.576 0.227 . . . . 0.0 111.465 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 48.58 35.77 6.58 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.376 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.15 62.29 4.76 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.279 0.561 . . . . 0.0 110.721 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -79.46 167.59 20.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.379 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -110.09 -37.85 5.46 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.707 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.74 14.92 15.76 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.71 39.94 29.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.843 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.501 -0.761 . . . . 0.0 111.164 -179.955 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.808 0.337 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 m -113.36 91.38 3.63 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.806 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -106.81 164.74 11.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.156 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.643 ' HB ' HD12 ' A' ' 36' ' ' ILE . 5.2 tt -115.26 130.38 69.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.021 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.62 101.98 8.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.472 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.36 -41.07 92.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.909 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -59.67 -51.63 68.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.948 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.621 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.12 -52.83 63.22 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.951 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.46 -39.39 73.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.153 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -44.94 96.32 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.99 67.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.25 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.474 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.41 -48.21 73.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.264 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.542 ' HE2' HG22 ' A' ' 105' ' ' VAL . 0.7 OUTLIER -56.18 -46.97 79.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.886 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -55.89 -40.84 73.58 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.468 HD21 HG21 ' A' ' 24' ' ' VAL . 15.9 tp -65.46 -44.52 86.92 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.972 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 13' ' ' ALA . 27.6 t -65.89 -35.01 74.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.779 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -61.17 -33.54 73.6 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 22' ' ' SER . 3.5 t70 -54.87 131.21 43.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.034 0.445 . . . . 0.0 111.054 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.74 -38.68 67.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.593 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -155.25 87.55 0.13 Allowed Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.809 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.428 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 3.2 t -118.67 30.14 7.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.769 0.319 . . . . 0.0 111.401 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 58.15 26.92 14.32 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.671 HG11 ' HB3' ' A' ' 41' ' ' GLN . 58.2 t -144.99 125.37 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-O 120.732 0.301 . . . . 0.0 110.906 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.508 HD12 HG23 ' A' ' 62' ' ' VAL . 1.3 pp -112.46 -28.57 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.749 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -131.24 155.61 46.81 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.581 HG22 ' HB3' ' A' ' 61' ' ' PHE . 34.7 m -140.85 149.51 20.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.005 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.63 175.89 6.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.85 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -151.13 93.59 1.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.404 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -102.87 176.0 5.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -89.67 144.11 26.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.111 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.511 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.5 OUTLIER -122.77 79.09 1.6 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.888 178.95 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -72.58 2.13 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.468 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.4 m -150.13 31.89 0.68 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.806 0.336 . . . . 0.0 110.766 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.0 p -146.39 176.97 9.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.033 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.643 HD12 ' HB ' ' A' ' 5' ' ' ILE . 10.9 mt -106.85 131.39 56.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.182 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.511 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 23.2 m -145.73 138.45 13.89 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.926 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.621 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 32.1 Cg_exo -58.21 168.22 3.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.468 2.112 . . . . 0.0 112.804 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.73 -153.78 7.15 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.993 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.425 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.4 mp0 -35.47 141.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.286 0.634 . . . . 0.0 112.428 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.671 ' HB3' HG11 ' A' ' 24' ' ' VAL . 23.6 mt-30 -136.84 98.12 3.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.356 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.42 168.62 25.76 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.839 -0.695 . . . . 0.0 113.209 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.415 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.88 -19.35 27.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.634 0.254 . . . . 0.0 110.86 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -89.97 111.27 22.29 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.7 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -68.0 -24.53 65.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.603 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.542 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -48.63 -36.09 15.07 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.016 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.25 -35.31 79.92 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.264 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.541 ' HE2' HD11 ' A' ' 120' ' ' LEU . 80.1 t80 -68.03 -40.6 82.86 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.561 0.22 . . . . 0.0 111.04 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.542 HD12 ' HA ' ' A' ' 46' ' ' GLN . 18.1 mt -64.31 -44.69 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.167 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -64.64 -40.8 96.09 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.768 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.39 -29.2 59.75 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.5 83.94 3.9 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.962 0.41 . . . . 0.0 111.35 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.61 173.59 8.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.577 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.2 2.8 17.03 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.686 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -126.41 77.37 1.69 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.751 0.31 . . . . 0.0 110.586 -179.659 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.684 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -170.11 -175.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.372 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.419 ' HD3' ' HG2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -169.39 74.36 0.09 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.2 pp -129.39 168.12 16.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.338 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -96.38 170.54 9.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.87 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.418 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -142.0 145.21 34.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.972 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.581 ' HB3' HG22 ' A' ' 27' ' ' VAL . 1.1 t80 -132.77 128.55 37.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 9.8 p -150.38 134.31 8.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.841 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 ttp-105 -103.91 132.38 50.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -104.3 161.65 13.88 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.919 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 65' ' ' THR . 8.9 t -146.16 110.26 4.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.724 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 t -108.56 135.92 49.03 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.347 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.18 136.09 5.06 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.922 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.422 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -80.21 -178.47 6.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.35 8.55 0.31 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.422 ' H ' ' C ' ' A' ' 68' ' ' ASP . 14.1 ptm -157.64 21.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.75 166.5 33.23 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.771 0.319 . . . . 0.0 111.266 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.9 127.55 7.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.187 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.14 155.66 46.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.988 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.1 t -126.92 136.6 52.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.443 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mtmt -137.56 144.31 41.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.435 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.504 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 6.4 m-85 -90.03 153.54 20.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.034 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 62' ' ' VAL . . . -140.31 114.88 9.41 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.243 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.497 HD11 HG12 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -103.33 93.22 4.86 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.638 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.641 HD13 HD13 ' A' ' 125' ' ' ILE . 5.4 mt -96.53 155.61 3.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.879 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.566 ' HB ' HG23 ' A' ' 113' ' ' VAL . 7.1 m -133.72 132.0 40.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.668 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.522 ' CE3' HD22 ' A' ' 120' ' ' LEU . 55.1 t-105 -108.71 129.38 55.36 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.853 0.359 . . . . 0.0 110.97 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 82' ' ' ILE . 2.9 tt -125.73 100.87 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.718 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.413 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -75.37 113.91 4.1 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.086 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.6 mm-40 -24.56 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.686 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.3 m-80 -71.26 44.27 0.09 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.105 0.479 . . . . 0.0 111.67 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 84' ' ' GLU . 9.0 t -77.47 142.58 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.471 179.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 162.05 29.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.029 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.17 -61.92 6.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.975 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -34.55 76.2 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.491 0.186 . . . . 0.0 111.217 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.419 ' HG2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -57.94 -33.36 68.74 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.29 179.688 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -52.91 -38.38 61.73 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.983 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.3 -37.09 23.9 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.101 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -57.59 -43.32 84.55 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.298 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.6 p -59.26 -37.6 78.02 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.267 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.92 -50.43 60.95 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.613 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.9 t -67.64 -31.54 71.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.624 0.249 . . . . 0.0 111.018 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.62 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.73 -39.17 83.79 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.243 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -57.0 -33.42 67.12 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.786 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.9 m -72.48 -44.33 62.45 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 97' ' ' ASP . 17.5 mt -59.56 -45.31 92.22 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.991 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 78' ' ' LEU . 46.1 t -65.78 -40.04 86.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 -36.6 80.68 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -45.76 78.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.739 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 29.6 t -71.87 -45.65 63.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.542 HG22 ' HE2' ' A' ' 14' ' ' TYR . 21.3 t -106.04 101.57 12.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.869 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -107.57 -32.24 7.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.443 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -81.44 71.82 8.45 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.903 0.382 . . . . 0.0 110.669 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.475 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 19.9 p90 -124.16 162.26 23.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.068 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.29 -46.52 5.78 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.66 132.0 15.58 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.067 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -133.43 127.87 34.3 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.417 ' HE2' HD11 ' A' ' 114' ' ' ILE . 14.2 p90 -160.35 162.45 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.981 0.42 . . . . 0.0 111.604 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.566 HG23 ' HB ' ' A' ' 80' ' ' THR . 11.2 p -109.07 143.02 20.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.534 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.657 HD13 ' HA ' ' A' ' 120' ' ' LEU . 4.4 mt -128.13 136.99 58.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.9 m -100.96 -31.52 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.063 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -88.6 139.09 30.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.947 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 mmm-85 -70.5 -36.45 73.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.167 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -47.86 77.57 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.674 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -70.07 -23.85 63.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.008 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.657 ' HA ' HD13 ' A' ' 114' ' ' ILE . 6.7 tp -81.61 -21.64 38.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.8 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -47.88 138.78 8.41 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.094 0.473 . . . . 0.0 111.567 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -35.44 21.52 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.049 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -38.84 75.59 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.983 0.42 . . . . 0.0 110.175 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -77.85 -42.04 34.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.641 HD13 HD13 ' A' ' 79' ' ' ILE . 49.8 mt -58.75 -50.09 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.029 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -54.8 -39.32 68.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.2 t -72.4 -44.37 62.57 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -58.12 -48.1 81.26 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.976 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.481 ' CD1' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -61.02 -31.5 71.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.101 179.665 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -49.44 71.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.957 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -70.1 -52.24 25.32 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.882 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 59.01 32.55 22.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.462 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 86.78 -49.53 4.04 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.798 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 117.71 107.4 2.4 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.134 -0.555 . . . . 0.0 111.834 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -168.76 25.11 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.69 0.281 . . . . 0.0 111.695 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -150.48 21.14 0.83 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.862 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.15 -56.06 4.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.616 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -81.61 150.37 28.16 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.231 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.07 -56.51 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.194 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -131.97 17.51 4.63 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.66 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 6.3 m 60.22 62.33 1.62 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.464 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.118 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.94 0.4 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.07 130.12 40.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.677 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -135.69 -179.9 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.006 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 tt -146.29 133.13 14.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.886 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.592 ' HB3' HG12 ' A' ' 37' ' ' VAL . 6.8 t70 -77.27 112.74 14.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.744 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.44 -45.28 76.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.058 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.81 -50.17 74.84 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.671 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -60.0 -57.0 14.74 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.305 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.628 ' HB3' HG11 ' A' ' 104' ' ' VAL . 34.2 m -58.49 -46.66 86.24 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.407 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -60.42 -49.66 76.68 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.42 -47.65 69.41 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.903 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.452 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -58.81 -35.03 72.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.452 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -66.09 -62.1 1.67 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.31 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -64.08 -32.8 74.5 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.919 0.341 . . . . 0.0 111.919 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.5 tt -61.55 -49.66 75.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.749 0.309 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.489 HG21 HG21 ' A' ' 27' ' ' VAL . 46.7 t -75.4 -32.03 24.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -4.35 41.5 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.896 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -70.96 80.8 0.65 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.813 0.34 . . . . 0.0 111.14 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 52.92 25.37 3.92 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.386 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 68.25 72.53 0.8 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.092 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 26.4 p -66.55 -169.98 0.09 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.524 0.202 . . . . 0.0 110.932 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.85 52.88 1.29 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 111.15 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.576 HG11 ' HB3' ' A' ' 41' ' ' GLN . 49.4 t -152.92 101.77 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.281 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.486 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -85.81 -27.35 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.644 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.471 ' HD1' HD11 ' A' ' 25' ' ' ILE . 21.9 p-90 -138.46 153.85 48.84 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.344 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.778 HG13 ' HG2' ' A' ' 41' ' ' GLN . 3.4 t -139.45 152.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.992 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.582 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 1.7 m -92.15 165.85 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.757 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -149.69 99.45 2.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.225 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 153.09 52.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.855 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 36' ' ' ILE . 55.1 p90 -96.07 128.77 43.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.414 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.19 109.02 21.85 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.842 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.62 -50.66 3.87 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.195 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.6 p -171.14 -33.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -83.5 132.62 34.93 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.876 0.37 . . . . 0.0 111.41 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.476 ' HA ' ' HA ' ' A' ' 31' ' ' TYR . 50.7 mt -79.5 136.07 24.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.954 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.592 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.6 m -151.03 155.94 35.19 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.671 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 43.3 Cg_endo -67.86 164.72 30.51 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.318 2.012 . . . . 0.0 112.09 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.582 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -134.38 -150.76 6.23 Favored Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.554 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.6 mp0 -31.59 136.13 0.06 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.461 0.705 . . . . 0.0 112.579 -179.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.778 ' HG2' HG13 ' A' ' 27' ' ' VAL . 8.2 mt-30 -130.69 91.37 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.228 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.66 164.18 25.18 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.26 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.486 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -88.35 -23.46 23.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.686 0.279 . . . . 0.0 110.718 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.96 115.51 22.85 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.688 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.427 ' HD2' HD11 ' A' ' 49' ' ' ILE . 30.3 t80 -67.22 -22.46 65.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.93 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -48.07 -37.2 14.59 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.663 179.512 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -38.67 91.87 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.298 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 47.0 t80 -67.91 -41.73 82.23 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.633 0.254 . . . . 0.0 111.013 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 46' ' ' GLN . 21.8 mt -63.51 -42.49 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.64 -40.5 73.05 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.642 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -34.29 68.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.623 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.5 m -76.44 82.98 3.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.961 0.41 . . . . 0.0 111.431 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.49 162.18 24.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -84.83 13.27 6.04 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.777 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -129.2 52.71 1.94 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 110.721 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 171.69 148.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.847 -179.492 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.537 ' HB3' HG23 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -111.3 129.13 56.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.73 179.554 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.43 174.47 10.6 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -115.79 167.2 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.264 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -151.82 154.01 35.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 111.415 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.506 ' CE1' HG11 ' A' ' 105' ' ' VAL . 1.7 t80 -136.21 110.07 8.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.12 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 t -115.29 122.68 69.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.723 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.41 107.72 18.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.84 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -103.59 159.17 15.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.052 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 6.8 t -148.51 127.17 12.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.1 p -113.99 88.71 2.91 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.061 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.401 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.36 175.25 37.13 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.553 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -159.91 79.16 0.69 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 111.072 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.55 31.11 1.25 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.55 -34.84 0.18 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.527 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -158.42 80.14 0.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.995 0.426 . . . . 0.0 110.551 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 3.6 mttt -79.67 98.61 7.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.802 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.419 ' O ' ' HA ' ' A' ' 65' ' ' THR . 4.8 tpp180 -100.41 110.97 23.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.798 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.5 140.58 29.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.019 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HD3' ' HG ' ' A' ' 129' ' ' LEU . 20.6 mttm -130.87 121.99 26.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.961 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -96.08 117.6 31.03 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.426 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.721 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -119.07 138.39 52.91 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.488 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 11.5 tp -117.7 100.18 7.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.559 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 39.0 mt -85.95 113.66 24.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.077 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.439 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 4.5 m -99.53 108.69 21.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.528 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -98.52 141.12 31.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.885 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.537 HG23 ' HB3' ' A' ' 57' ' ' ARG . 46.2 mt -139.9 94.1 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.261 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.693 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -62.84 109.77 2.9 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.518 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.3 mm-40 -33.78 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.662 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.6 m-80 -73.13 41.81 0.11 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.273 0.558 . . . . 0.0 111.575 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.693 HG13 ' O ' ' A' ' 83' ' ' GLY . 2.5 m -99.26 137.33 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.348 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 m -66.28 165.55 13.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.772 0.32 . . . . 0.0 111.23 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.08 -36.47 67.89 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.98 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.81 -36.12 82.86 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.553 0.216 . . . . 0.0 111.083 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -36.77 84.55 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.042 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.94 -45.27 78.84 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.782 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -35.71 74.19 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.197 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.11 -41.82 68.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.475 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -58.04 -39.26 77.99 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.136 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.23 -49.21 67.64 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.379 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -42.94 88.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.586 0.231 . . . . 0.0 110.964 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.559 ' O ' HG23 ' A' ' 101' ' ' VAL . 0.8 OUTLIER -60.39 -36.11 77.34 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.179 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -34.53 65.75 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.907 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 59.1 m -76.45 -47.79 21.85 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.903 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.401 ' O ' HG23 ' A' ' 104' ' ' VAL . 67.6 mt -60.87 -47.85 84.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.178 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 97' ' ' ASP . 45.5 t -64.59 -40.12 87.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.764 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -57.61 -44.96 85.86 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.856 179.376 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -59.7 -41.88 91.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.628 HG11 ' HB3' ' A' ' 10' ' ' CYS . 25.8 t -72.28 -37.8 59.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.409 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.506 HG11 ' CE1' ' A' ' 61' ' ' PHE . 21.6 t -125.52 104.15 12.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 120.873 0.368 . . . . 0.0 110.823 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 2.9 mt-30 -109.23 -40.38 4.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.095 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -86.62 85.5 7.3 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.059 0.457 . . . . 0.0 111.109 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -133.61 160.41 37.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.982 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.65 -51.18 29.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.03 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.8 161.7 3.87 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 6.6 pt-20 -148.08 150.04 33.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.051 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.618 ' CE1' HD11 ' A' ' 114' ' ' ILE . 12.2 p90 -157.41 160.79 38.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.152 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.439 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 10.2 p -102.32 142.59 16.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.99 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.618 HD11 ' CE1' ' A' ' 112' ' ' PHE . 3.9 mt -134.68 141.85 42.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.063 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 t -135.15 31.26 3.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.848 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.566 ' H ' HG22 ' A' ' 114' ' ' ILE . 30.4 t70 -145.12 136.55 25.18 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.705 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -59.0 -36.56 75.12 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.68 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -69.17 -44.7 71.69 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.556 0.217 . . . . 0.0 110.84 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.431 ' HB2' HG23 ' A' ' 114' ' ' ILE . 45.1 mt-10 -73.35 -31.22 63.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.159 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.405 ' N ' HG21 ' A' ' 114' ' ' ILE . 3.5 tp -74.0 -28.55 61.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.09 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -45.45 133.18 7.63 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.448 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -51.14 -32.15 22.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.1 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -56.71 -41.38 77.31 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.976 0.417 . . . . 0.0 110.29 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -70.43 -46.01 64.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.903 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.476 HG21 HD11 ' A' ' 79' ' ' ILE . 20.1 mm -61.14 -46.12 97.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.228 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -60.53 -37.87 82.58 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.619 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.62 -42.26 74.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.657 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.16 -43.13 99.36 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.093 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.721 HD11 ' HB2' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -65.73 -43.4 89.13 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.237 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -64.31 -32.29 73.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.16 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.57 -49.36 36.92 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.239 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -110.14 43.27 1.39 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.983 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -139.01 -50.83 0.05 OUTLIER Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.717 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -92.2 -163.61 37.99 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.599 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -117.96 33.82 5.45 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.673 0.273 . . . . 0.0 111.282 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 50.6 47.65 23.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.042 0.449 . . . . 0.0 110.985 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -68.94 -26.97 65.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.562 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -59.03 154.52 15.42 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.067 0.461 . . . . 0.0 110.934 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -113.68 -20.34 11.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.546 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -91.17 13.62 16.52 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 11.1 t -158.45 46.09 0.32 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.087 0.47 . . . . 0.0 110.932 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.91 179.824 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.649 0.262 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 m -121.25 144.38 48.64 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.743 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -134.48 167.37 20.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.025 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -123.29 122.82 66.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.426 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 4.0 t70 -75.31 107.18 7.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -70.31 -36.88 74.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.777 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -66.75 -46.64 74.75 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.91 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.809 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -64.77 -51.63 61.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.302 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.2 t -55.48 -44.8 76.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -65.77 -44.01 87.15 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.77 -49.61 47.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.131 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.705 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -70.56 -36.87 73.88 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.651 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -55.35 -55.1 35.42 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.54 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.443 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 21.6 p30 -75.23 -20.97 58.95 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.3 -44.18 46.94 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.612 0.244 . . . . 0.0 111.318 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 13' ' ' ALA . 19.4 t -72.5 -40.16 62.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.513 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -59.16 -25.75 64.17 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.49 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.31 125.58 27.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.807 0.337 . . . . 0.0 110.797 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -90.42 35.49 0.87 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.256 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.45 -32.44 2.14 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.941 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.26 157.98 16.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.05 0.425 . . . . 0.0 111.33 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.88 59.34 3.13 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.65 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.2 t -129.0 108.42 17.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.033 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.463 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.2 pt -106.32 -29.89 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.651 ' HB2' HG22 ' A' ' 62' ' ' VAL . 31.0 p-90 -135.16 155.99 49.76 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.928 0.394 . . . . 0.0 111.179 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 16.7 m -141.38 149.05 20.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.225 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.533 HG22 ' H ' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -92.68 175.94 6.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.59 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.556 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 5.6 m-85 -144.82 104.73 4.04 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.007 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.98 -179.2 4.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.401 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -84.09 163.74 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.52 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.453 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -147.36 84.63 1.57 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.817 179.333 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 75.15 -68.64 2.0 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.303 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -156.68 34.88 0.31 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.8 t -158.39 158.46 34.28 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.428 HG12 ' OD2' ' A' ' 97' ' ' ASP . 3.6 mt -84.93 134.6 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.12 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.458 ' HB ' ' HD2' ' A' ' 38' ' ' PRO . 30.7 m -147.54 157.36 44.85 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.009 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.809 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.9 Cg_endo -65.88 171.37 9.99 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.335 2.023 . . . . 0.0 112.146 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.498 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -135.91 -151.91 6.25 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.53 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.531 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.35 140.27 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.418 0.687 . . . . 0.0 112.248 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -135.33 100.94 4.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.184 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.52 161.5 24.48 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.128 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.463 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.56 -26.75 34.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 0.0 110.52 179.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -96.04 122.42 38.85 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.533 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -68.2 -18.09 64.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.905 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.719 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -47.58 -40.12 18.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.623 0.249 . . . . 0.0 110.973 179.634 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.19 -39.66 91.03 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.226 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 39.8 t80 -66.43 -47.6 72.67 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.893 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.719 HD12 ' HA ' ' A' ' 46' ' ' GLN . 4.9 mt -58.18 -38.5 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.714 0.292 . . . . 0.0 110.781 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.41 -36.38 83.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.574 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.06 -23.44 22.55 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.599 ' SG ' HD22 ' A' ' 120' ' ' LEU . 0.4 OUTLIER -73.46 81.97 1.45 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.212 -179.796 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.2 p -109.48 146.13 35.09 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.638 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.583 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.7 m-20 -80.07 70.14 6.61 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.01 0.433 . . . . 0.0 111.385 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.706 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.9 t70 -165.5 45.08 0.08 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.204 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.765 HG13 ' N ' ' A' ' 57' ' ' ARG . 2.9 p 178.29 -147.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.765 ' N ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -163.71 123.41 2.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.392 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.1 pp -158.85 156.8 30.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.878 0.371 . . . . 0.0 111.322 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.556 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 67.3 m-85 -99.69 172.21 7.41 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.554 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -150.22 156.22 41.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -147.24 122.11 9.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.68 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.651 HG22 ' HB2' ' A' ' 26' ' ' TRP . 14.8 t -130.98 143.05 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-O 120.888 0.375 . . . . 0.0 111.507 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.478 ' HD2' HG12 ' A' ' 17' ' ' VAL . 60.7 mtt85 -121.71 112.67 18.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.551 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.598 ' HD2' HD22 ' A' ' 129' ' ' LEU . 16.2 m-85 -95.45 165.52 12.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.269 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 20.2 m -138.54 120.28 15.25 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.777 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 p -112.13 91.42 3.65 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.83 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.426 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -159.34 172.39 35.99 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.451 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -159.25 79.27 0.75 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 0.0 111.28 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.36 30.74 0.74 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.413 ' HG3' ' N ' ' A' ' 71' ' ' SER . 4.1 ptm -149.82 -34.23 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.413 ' N ' ' HG3' ' A' ' 70' ' ' MET . 28.9 p -158.87 81.77 0.79 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.708 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.426 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 18.1 tttm -79.63 101.09 8.15 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.368 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.437 ' O ' ' HA ' ' A' ' 65' ' ' THR . 8.6 mmt180 -102.34 149.39 24.39 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.028 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.36 147.74 32.23 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.534 ' HG2' HD23 ' A' ' 129' ' ' LEU . 2.2 tptt -130.25 162.04 29.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.932 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.428 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 14.7 m-85 -130.37 146.92 52.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.617 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.593 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -146.76 111.51 5.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.494 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 14.8 tp -103.48 86.74 2.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.895 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.725 HG21 HD12 ' A' ' 114' ' ' ILE . 2.2 mp -96.26 141.4 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.249 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.7 m -114.35 124.18 51.34 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.431 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.52 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 68.7 t-105 -94.18 133.55 37.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.834 0.349 . . . . 0.0 110.745 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.512 HG23 ' O ' ' A' ' 82' ' ' ILE . 3.0 tt -128.33 90.82 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.837 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.583 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.56 111.33 4.06 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.709 -0.757 . . . . 0.0 111.692 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -37.07 -45.84 0.63 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -178.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.706 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.1 m-80 -73.68 46.54 0.22 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 90' ' ' GLN . 12.4 p -104.89 134.59 45.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.25 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 p -63.17 153.87 33.02 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.938 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.36 58.58 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 113.2 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -43.25 92.22 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.797 0.299 . . . . 0.0 111.073 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.469 ' HB2' HG22 ' A' ' 86' ' ' VAL . 31.5 mm-40 -67.68 -33.78 75.61 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.997 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.408 ' O ' HG22 ' A' ' 94' ' ' THR . 0.0 OUTLIER -57.4 -34.63 69.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.951 179.446 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.56 -33.93 27.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.949 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.5 tptt -56.13 -44.07 78.82 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.477 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.408 HG22 ' O ' ' A' ' 91' ' ' ARG . 8.6 t -61.35 -34.16 74.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.727 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.54 -48.88 82.16 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.06 -0.59 . . . . 0.0 112.103 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -38.44 86.35 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.568 0.223 . . . . 0.0 110.718 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.53 ' HA ' HD12 ' A' ' 100' ' ' LEU . 4.5 m-20 -60.98 -44.88 96.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.099 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.4 ttpt -58.79 -29.9 67.18 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.8 m -71.99 -45.37 61.23 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.448 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 97' ' ' ASP . 6.2 mt -62.33 -47.65 83.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.098 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.414 ' HA ' HG12 ' A' ' 104' ' ' VAL . 12.5 p -66.2 -32.77 59.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -68.46 -38.18 80.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.763 0.316 . . . . 0.0 110.837 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -47.22 68.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.784 HG13 HG23 ' A' ' 105' ' ' VAL . 14.8 p -71.04 -33.13 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.642 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.784 HG23 HG13 ' A' ' 104' ' ' VAL . 21.9 t -109.17 91.87 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.939 0.399 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -98.83 -35.96 9.95 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.046 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -79.43 79.78 5.86 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 110.829 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -127.84 -179.78 5.13 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -114.11 -50.98 2.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.344 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.461 ' HE2' ' HB2' ' A' ' 132' ' ' ALA . 1.8 mttp -145.16 150.96 37.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.258 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 7.7 pt-20 -151.99 128.39 10.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.573 ' HE2' HD11 ' A' ' 114' ' ' ILE . 16.4 p90 -159.78 159.43 32.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.341 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.73 146.1 7.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.727 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.725 HD12 HG21 ' A' ' 79' ' ' ILE . 58.7 mt -132.85 144.71 35.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.11 31.26 2.43 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.078 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.532 ' H ' HG22 ' A' ' 114' ' ' ILE . 38.6 t70 -147.07 140.54 25.54 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.916 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.501 ' HA ' HD21 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -60.9 -34.96 75.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.462 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.1 tttm -75.3 -37.85 60.62 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.73 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.48 ' CB ' HG23 ' A' ' 114' ' ' ILE . 30.7 mt-10 -67.2 -45.09 77.91 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.825 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.599 HD22 ' SG ' ' A' ' 52' ' ' CYS . 4.5 pp -72.02 -22.15 61.45 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.343 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -48.27 133.57 15.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.769 0.319 . . . . 0.0 110.874 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -49.15 -34.09 13.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.058 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -60.09 -46.29 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.894 0.378 . . . . 0.0 110.285 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -68.51 -44.23 75.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.107 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.412 HG22 HD13 ' A' ' 129' ' ' LEU . 37.5 mm -59.85 -45.24 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.13 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -57.34 -39.85 76.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.105 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.7 t -71.52 -46.19 60.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.727 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -57.08 -39.84 75.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.598 HD22 ' HD2' ' A' ' 64' ' ' PHE . 1.9 mp -72.51 -37.75 68.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.522 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -68.84 -56.27 8.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.5 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -75.23 -58.68 3.13 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.101 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.461 ' HB2' ' HE2' ' A' ' 110' ' ' LYS . . . 53.14 40.49 31.31 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.843 0.354 . . . . 0.0 111.517 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -94.54 -39.78 4.62 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.638 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.77 20.86 70.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 121.255 -0.498 . . . . 0.0 113.466 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -173.24 24.01 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -148.91 21.6 0.99 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.959 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -89.53 -49.37 6.72 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.694 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.66 159.56 37.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.069 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -115.31 -35.6 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.552 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.96 18.14 12.53 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 111.66 0.244 . . . . 0.0 111.66 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 14.4 t 44.11 47.4 7.46 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.797 0.439 . . . . 0.0 111.796 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.874 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 120.578 0.228 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.87 102.32 10.84 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.601 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -104.86 162.28 13.46 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.09 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -118.73 135.45 59.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.07 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.32 115.02 22.83 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.4 -41.64 93.44 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.078 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.32 -44.78 78.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.147 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.672 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -60.24 -59.57 5.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.238 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.8 m -55.73 -43.68 76.82 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.384 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -65.02 -41.66 95.08 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.484 ' HA ' ' ND2' ' A' ' 15' ' ' ASN . . . -55.18 -55.53 30.21 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.845 0.355 . . . . 0.0 110.733 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.504 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -59.59 -38.49 81.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.674 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -57.68 -50.53 72.88 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.484 ' ND2' ' HA ' ' A' ' 12' ' ' ALA . 13.0 p30 -62.13 -29.49 70.37 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.84 -45.36 15.65 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.691 0.281 . . . . 0.0 111.34 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.689 HG11 HG11 ' A' ' 27' ' ' VAL . 27.1 m -64.82 -29.75 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.698 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -56.62 -40.07 74.73 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.177 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.68 124.12 20.62 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.604 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.72 39.48 1.21 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.223 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -165.74 37.34 0.27 Allowed Glycine 0 C--N 1.335 0.506 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.836 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -123.49 26.02 8.01 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.907 0.354 . . . . 0.0 111.483 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 60.1 28.01 17.52 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.713 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 41' ' ' GLN . 60.3 t -139.13 114.54 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.74 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.483 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.3 pt -110.97 -27.56 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 40.8 p-90 -128.19 161.82 28.41 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.883 0.373 . . . . 0.0 111.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.689 HG11 HG11 ' A' ' 17' ' ' VAL . 0.8 OUTLIER -144.07 151.87 16.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.521 179.178 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.455 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 64.0 m -93.21 161.08 14.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.692 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -146.12 99.24 3.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.997 0.427 . . . . 0.0 110.274 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.23 -179.57 5.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.703 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.925 ' HB3' HD13 ' A' ' 36' ' ' ILE . 52.2 p90 -131.54 132.94 44.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.204 0.526 . . . . 0.0 111.547 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -104.03 114.0 27.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.238 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.67 -74.35 1.78 Allowed Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.998 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 m -162.09 33.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.542 0.21 . . . . 0.0 111.515 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.4 p -140.7 134.58 30.55 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.851 0.357 . . . . 0.0 111.039 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.925 HD13 ' HB3' ' A' ' 31' ' ' TYR . 39.9 mm -81.69 130.9 35.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.814 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.448 HG12 ' CB ' ' A' ' 9' ' ' ALA . 16.7 m -152.62 142.59 15.01 Favored Pre-proline 0 C--O 1.233 0.212 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.213 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.672 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 38.2 Cg_exo -60.24 165.7 10.4 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.504 2.136 . . . . 0.0 112.276 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.455 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -134.95 -149.05 5.8 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.449 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.449 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.1 mp0 -34.88 136.48 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.388 0.675 . . . . 0.0 112.514 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.411 ' HB3' HG11 ' A' ' 24' ' ' VAL . 14.2 mt-30 -137.32 98.87 3.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.281 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.68 165.85 27.09 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.415 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.483 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.32 -22.04 33.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.679 -0.26 . . . . 0.0 110.79 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -88.45 109.44 20.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.537 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -66.86 -21.12 66.02 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.4 -39.2 21.67 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.767 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.51 -36.97 84.25 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.3 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 45.9 t80 -70.11 -42.08 73.13 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.903 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 63.3 mt -60.51 -40.41 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.753 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -70.8 -36.15 72.86 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.438 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -34.34 58.59 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.695 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.29 82.96 1.38 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 111.656 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.16 155.9 25.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.067 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.77 11.27 6.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.757 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -128.25 53.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.833 0.349 . . . . 0.0 110.912 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.48 153.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.143 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.72 ' HB3' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -111.18 143.1 42.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.738 179.289 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -160.55 177.22 10.74 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.785 0.326 . . . . 0.0 111.591 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -116.49 158.73 23.13 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.937 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -147.99 164.27 34.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.985 0.421 . . . . 0.0 111.614 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.437 ' CE2' HG11 ' A' ' 105' ' ' VAL . 2.4 t80 -150.81 121.48 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.242 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 39.7 t -124.96 134.34 67.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.601 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -93.08 113.8 26.15 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.217 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.4 143.22 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.373 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 65' ' ' THR . 5.6 t -152.3 104.27 2.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.497 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.28 94.45 5.05 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.859 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.56 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.18 146.78 13.12 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.83 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.27 79.84 1.24 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.768 0.318 . . . . 0.0 110.973 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 41.45 62.53 1.5 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.298 0.57 . . . . 0.0 112.092 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -179.08 -46.92 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.3 m -158.71 100.2 1.6 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.322 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.56 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 4.2 mttt -93.24 128.36 39.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.093 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -133.32 102.83 5.7 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.219 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.08 127.54 53.57 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.677 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -144.79 157.07 44.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.874 0.369 . . . . 0.0 111.366 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 15.5 m-85 -110.78 137.81 47.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.591 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.74 128.54 37.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.27 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 79' ' ' ILE . 1.4 tt -89.78 132.19 35.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.443 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 125' ' ' ILE . 14.8 mt -123.92 125.02 70.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.496 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.745 ' HB ' HG12 ' A' ' 113' ' ' VAL . 8.9 m -106.54 119.82 40.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.093 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.62 ' CE3' HD12 ' A' ' 120' ' ' LEU . 37.6 t-105 -98.52 137.4 37.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 111.498 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.511 HG23 HG11 ' A' ' 86' ' ' VAL . 53.3 mt -137.4 87.27 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.932 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.5 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -63.2 106.46 1.33 Allowed Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.785 -0.643 . . . . 0.0 113.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 1.02 -65.22 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 10.8 m120 -45.94 -21.66 0.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.72 HG21 ' HB3' ' A' ' 57' ' ' ARG . 53.5 t -54.53 107.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.615 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 m -74.3 173.07 10.73 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.33 -43.15 57.37 Favored Glycine 0 C--N 1.336 0.567 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.061 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.58 -46.99 73.83 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.713 0.292 . . . . 0.0 110.808 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.693 ' HB3' HG13 ' A' ' 86' ' ' VAL . 9.3 mp0 -68.24 -37.67 81.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.358 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.428 ' O ' HG22 ' A' ' 94' ' ' THR . 7.6 mmt180 -58.03 -35.87 71.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 -38.91 71.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.93 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -59.72 -49.05 79.23 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.164 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.486 ' HB ' ' HD2' ' A' ' 57' ' ' ARG . 9.2 t -61.04 -33.38 73.21 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.23 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.72 93.65 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.963 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.18 -38.72 66.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.56 0.219 . . . . 0.0 110.498 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -58.19 -41.4 83.87 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.344 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -55.79 -33.68 64.6 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.745 0.307 . . . . 0.0 110.648 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.2 m -70.52 -44.43 67.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.426 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 61.9 mt -58.38 -49.35 77.56 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.674 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.1 t -64.98 -38.85 83.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.022 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 ttmt -60.95 -44.34 97.41 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.145 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -58.42 -45.34 88.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.69 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 t -74.89 -41.05 46.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.674 HG13 ' HE2' ' A' ' 14' ' ' TYR . 38.8 t -104.53 74.48 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 121.067 0.461 . . . . 0.0 110.754 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -77.62 -26.37 50.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.418 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.98 83.57 5.86 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.843 0.354 . . . . 0.0 110.73 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -132.42 158.43 42.02 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -110.51 -48.93 3.1 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.341 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.55 116.7 7.88 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.026 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -122.32 131.21 53.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.964 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -158.01 154.95 28.52 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.028 0.442 . . . . 0.0 111.51 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.745 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.3 m -89.68 156.28 3.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.357 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.57 HG22 ' H ' ' A' ' 116' ' ' ASP . 57.8 mt -138.51 140.6 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.955 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -124.25 13.35 8.93 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.78 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.57 ' H ' HG22 ' A' ' 114' ' ' ILE . 8.7 p-10 -148.44 144.28 27.32 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.942 0.401 . . . . 0.0 110.871 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -60.27 -29.71 68.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.989 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -46.75 88.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.731 0.301 . . . . 0.0 110.855 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.422 ' CB ' HG23 ' A' ' 114' ' ' ILE . 1.0 OUTLIER -74.26 -25.81 59.84 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.621 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.62 HD12 ' CE3' ' A' ' 81' ' ' TRP . 0.4 OUTLIER -83.41 -22.77 32.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.675 0.274 . . . . 0.0 111.045 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.431 ' HG2' ' OD1' ' A' ' 123' ' ' ASN . 12.5 tt0 -54.48 133.13 45.81 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.76 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -49.15 -45.08 43.29 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.177 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.431 ' OD1' ' HG2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -58.48 -32.79 69.1 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.25 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.414 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 20.6 t80 -74.81 -51.01 15.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.824 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 79' ' ' ILE . 21.6 mt -59.0 -48.18 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.071 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -55.0 -38.6 68.06 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.9 t -66.09 -49.11 68.69 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.04 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -60.26 -50.27 74.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.91 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.09 -37.19 84.12 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.4 tttp -69.5 -45.48 68.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.612 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp -74.45 -68.05 0.57 Allowed 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.057 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 55.38 51.84 12.31 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.87 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -121.13 33.51 4.34 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.096 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . -127.56 88.96 0.33 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.296 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 75.88 19.6 1.9 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.884 0.373 . . . . 0.0 111.278 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -155.06 24.73 0.43 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.743 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -63.99 -27.82 69.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.59 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -64.85 157.36 28.05 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.971 0.415 . . . . 0.0 111.02 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -172.58 -64.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.94 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -143.5 16.92 1.85 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.872 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.5 m -95.66 -52.14 4.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.065 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.686 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.429 ' CB ' HG21 ' A' ' 96' ' ' THR . . . . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.797 0.332 . . . . 0.0 111.26 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.12 139.89 45.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -100.25 147.21 26.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.516 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.447 ' HB ' HD13 ' A' ' 100' ' ' LEU . 2.9 tt -124.68 131.05 73.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -89.08 108.11 19.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.565 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -67.9 -34.05 75.89 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.153 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -54.89 40.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.218 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -67.97 -46.28 71.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.339 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 m -58.32 -45.09 88.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.302 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -68.77 -45.08 72.31 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.52 -46.66 73.56 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.781 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.569 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -62.07 -47.62 83.84 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -56.2 -43.32 78.37 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.143 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -59.44 -46.17 89.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.4 HD22 ' OE1' ' A' ' 41' ' ' GLN . 1.4 tt -65.31 -43.75 90.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.826 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 13' ' ' ALA . 47.6 t -66.72 -31.18 52.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.729 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -37.71 70.57 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.699 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.95 125.62 26.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.703 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -99.34 25.59 6.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.049 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.16 -32.35 4.06 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.862 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -82.91 159.93 22.21 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.834 0.317 . . . . 0.0 111.112 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.45 ' O ' HG23 ' A' ' 25' ' ' ILE . . . -62.85 -22.27 66.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.795 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.5 t -54.77 118.54 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.604 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 43' ' ' ALA . 31.7 pt -113.78 -36.29 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.718 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.688 ' CB ' HG22 ' A' ' 62' ' ' VAL . 37.3 p-90 -136.21 157.61 46.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.037 0.446 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.422 ' CG2' HG21 ' A' ' 17' ' ' VAL . 4.6 m -138.64 144.74 29.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.473 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.447 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 97.5 m -84.9 162.53 19.43 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.553 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.53 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 6.9 m-85 -144.75 96.41 2.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.127 0.489 . . . . 0.0 110.21 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' HB3' HD22 ' A' ' 58' ' ' LEU . 1.5 pttt -125.86 179.93 4.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.681 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.733 ' HB3' HD13 ' A' ' 36' ' ' ILE . 51.1 p90 -109.4 125.4 52.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.926 0.393 . . . . 0.0 111.301 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.84 101.04 12.83 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.02 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.12 -68.89 2.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.887 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.7 p -160.17 33.08 0.17 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.633 0.254 . . . . 0.0 111.231 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -149.91 131.06 14.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.733 HD13 ' HB3' ' A' ' 31' ' ' TYR . 37.6 mm -71.31 129.68 35.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.986 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.463 HG12 ' HB3' ' A' ' 9' ' ' ALA . 4.0 m -152.22 157.43 33.95 Favored Pre-proline 0 C--O 1.234 0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.111 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 29.4 Cg_endo -62.46 162.59 23.57 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.653 2.236 . . . . 0.0 112.499 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.447 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -138.22 -146.93 5.11 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.706 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.507 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 1.9 mp0 -30.3 133.88 0.06 Allowed 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.499 0.719 . . . . 0.0 112.895 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.4 ' OE1' HD22 ' A' ' 16' ' ' LEU . 2.8 tt0 -131.42 101.14 5.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.001 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.03 165.32 25.16 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.503 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.479 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.37 -12.13 33.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.254 0.222 . . . . 0.0 111.464 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -116.08 134.04 55.37 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.668 0.271 . . . . 0.0 110.542 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -69.96 -19.16 63.37 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.894 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -49.81 -40.12 40.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.651 0.262 . . . . 0.0 110.84 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -36.16 79.22 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.403 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' ALA . 42.2 t80 -64.78 -61.12 2.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 121.289 -0.164 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 40.6 mt -57.59 -30.77 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.159 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -47.0 85.8 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.905 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -99.57 -0.16 41.03 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -88.45 88.83 7.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.036 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.1 156.86 17.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.921 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.505 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.1 p-10 -80.48 62.44 4.58 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.512 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.775 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.2 t0 -161.62 43.45 0.15 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.314 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.775 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.86 153.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.722 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.7 127.3 52.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.327 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' A' ' 30' ' ' LYS . 13.4 mt -142.58 156.38 45.09 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.924 0.392 . . . . 0.0 111.671 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.53 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 78.9 m-85 -104.29 161.22 14.23 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.186 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.438 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -154.15 146.47 23.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.879 0.371 . . . . 0.0 111.505 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -128.56 110.7 12.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.523 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.688 HG22 ' CB ' ' A' ' 26' ' ' TRP . 18.2 t -125.93 131.13 72.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.889 0.376 . . . . 0.0 111.361 -179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.9 mtm-85 -88.3 151.48 22.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.692 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -127.83 158.98 36.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.2 t -142.63 129.27 20.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.732 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.8 p -119.29 88.9 3.02 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.53 175.3 37.28 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.75 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.94 79.38 0.69 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.078 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 41.47 40.61 1.35 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.359 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 ptt? -157.94 -39.31 0.07 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.433 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.5 m -155.4 87.47 1.11 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.749 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 110.18 15.5 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.949 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.9 mtp180 -110.47 111.86 23.4 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.101 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.6 t -84.2 144.65 28.81 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -143.3 157.0 44.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.62 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 6.4 m-85 -107.49 147.74 30.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.71 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.457 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -147.7 115.81 6.52 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.445 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 5.6 tt -94.21 106.48 18.45 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.179 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.595 HG23 HD12 ' A' ' 114' ' ' ILE . 29.0 mm -94.67 120.95 44.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.285 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.481 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.1 OUTLIER -106.95 123.81 48.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.252 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.602 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 40.9 t-105 -105.85 136.01 46.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.04 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.464 HG22 HG21 ' A' ' 86' ' ' VAL . 36.7 mt -137.6 93.36 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.505 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -64.38 112.28 4.86 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.573 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.407 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.6 mt-10 -24.72 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.719 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.3 m-80 -72.16 43.23 0.1 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.577 HG13 ' HB3' ' A' ' 90' ' ' GLN . 11.6 t -75.77 126.87 36.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.596 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.5 p -73.11 163.74 27.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.991 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.08 -38.77 39.96 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 121.215 -0.517 . . . . 0.0 113.084 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.6 mp -81.6 -40.52 22.88 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.577 ' HB3' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -58.01 -37.32 74.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.458 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -41.39 89.11 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.628 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.27 -38.54 78.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.753 179.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -52.87 -41.45 64.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.21 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 m -52.51 -46.78 66.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.376 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.7 -47.71 74.02 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.917 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.429 HG21 ' CB ' ' A' ' 2' ' ' ALA . 0.8 OUTLIER -63.42 -45.51 90.61 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.989 0.395 . . . . 0.0 111.008 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.448 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 78.6 m-20 -64.69 -39.21 93.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.318 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -57.27 -33.6 67.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.767 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.1 m -71.33 -48.7 48.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.557 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.687 ' O ' HG23 ' A' ' 104' ' ' VAL . 52.6 mt -56.04 -51.69 66.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 97' ' ' ASP . 44.1 t -60.81 -39.55 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.143 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -55.0 -41.92 71.86 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.999 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.84 -34.08 66.56 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.228 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 100' ' ' LEU . 33.8 t -67.64 -47.08 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.531 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 26.4 t -106.89 114.98 47.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -107.24 -29.08 9.53 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.283 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -93.83 88.0 5.61 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.737 0.303 . . . . 0.0 111.03 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -141.61 168.75 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -101.38 -53.87 2.9 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.456 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -150.34 147.44 27.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.605 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 5.2 pt-20 -142.88 120.12 11.52 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.61 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -145.84 148.47 32.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.874 0.368 . . . . 0.0 111.262 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.481 HG12 ' HB ' ' A' ' 80' ' ' THR . 6.1 m -81.31 160.59 3.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.474 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.714 HD13 ' HA ' ' A' ' 120' ' ' LEU . 77.3 mt -141.09 132.86 28.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.103 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 m -116.61 -17.65 10.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.846 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.47 151.99 32.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.891 0.377 . . . . 0.0 111.176 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.492 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 32.1 ttp180 -64.2 -26.41 68.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.615 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 6.9 tptp -68.31 -38.06 81.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.993 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.67 ' CB ' HG23 ' A' ' 114' ' ' ILE . 1.2 mt-10 -73.4 -39.31 65.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.646 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.714 ' HA ' HD13 ' A' ' 114' ' ' ILE . 4.2 pp -74.77 -15.97 60.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.251 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -51.46 130.15 26.87 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.986 0.422 . . . . 0.0 110.697 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -48.05 -44.74 31.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.714 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -62.8 -41.31 99.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.939 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 32.9 t80 -59.47 -52.24 66.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.22 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.526 HG21 HD11 ' A' ' 79' ' ' ILE . 11.5 mt -55.21 -42.9 68.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -57.29 -40.99 78.92 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 32.6 t -69.27 -41.96 76.17 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.71 88.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.253 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.457 HD21 ' HB2' ' A' ' 77' ' ' ALA . 4.7 mp -71.05 -33.03 69.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.53 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -76.09 -48.88 19.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.326 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -69.11 0.55 Allowed 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.826 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 43.07 56.41 4.12 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 57.73 60.23 9.37 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.288 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.421 ' O ' ' HB2' ' A' ' 135' ' ' ALA . . . -65.96 -122.87 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.285 -0.483 . . . . 0.0 112.951 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 134' ' ' GLY . . . 177.36 27.27 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -132.47 13.99 4.53 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.919 0.39 . . . . 0.0 111.269 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -69.87 -43.98 70.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.219 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -74.69 149.75 39.77 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.042 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.485 ' HB1' HG22 ' A' ' 141' ' ' THR . . . -101.77 -32.9 10.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.33 15.48 9.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.884 0.373 . . . . 0.0 111.583 -179.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' THR . . . . . 0.485 HG22 ' HB1' ' A' ' 139' ' ' ALA . 15.4 t -131.47 37.26 3.7 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.157 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.733 0.301 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.617 HG23 ' HE2' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -94.92 129.12 42.08 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.068 -179.875 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -136.52 145.04 44.62 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.531 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.526 HD12 HD11 ' A' ' 36' ' ' ILE . 13.9 tt -112.72 128.67 69.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 6.1 t0 -75.69 102.49 5.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.556 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -34.59 74.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.009 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -69.6 -50.12 47.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.898 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.517 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -62.46 -54.26 42.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.3 t -56.02 -37.09 68.71 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.813 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -60.04 -52.61 64.62 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.59 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -52.85 -48.77 66.82 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.126 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.545 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -58.27 -36.42 73.23 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.59 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.542 ' CE2' HG13 ' A' ' 105' ' ' VAL . 0.4 OUTLIER -60.86 -62.08 2.12 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.267 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -62.55 -33.44 74.94 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -60.94 -48.39 82.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.675 0.274 . . . . 0.0 110.819 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 13' ' ' ALA . 49.0 t -72.58 -30.66 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.46 -36.71 64.4 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.987 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.38 124.67 26.94 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.58 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -97.04 29.02 3.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -115.73 15.39 16.88 Favored Glycine 0 C--N 1.335 0.525 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.798 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 t -132.31 162.21 31.59 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.874 0.369 . . . . 0.0 110.972 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.72 58.35 2.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.054 0.454 . . . . 0.0 110.579 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.3 t -141.48 104.46 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.0 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.439 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -108.62 -26.37 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.563 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.424 ' HD1' HD11 ' A' ' 25' ' ' ILE . 26.8 p-90 -135.65 157.9 45.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.859 0.361 . . . . 0.0 111.333 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.572 HG22 ' HB3' ' A' ' 61' ' ' PHE . 27.0 m -140.99 150.06 20.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.268 179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.418 HG22 ' H ' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -97.47 174.71 6.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.967 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.418 ' H ' HG22 ' A' ' 28' ' ' THR . 2.3 m-85 -149.39 96.02 2.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.187 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.06 175.23 5.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.419 -179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.578 ' CE1' HG23 ' A' ' 36' ' ' ILE . 0.8 OUTLIER -104.18 120.7 41.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.912 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -102.54 89.82 3.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.201 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.63 -79.62 1.38 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.146 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.25 32.06 1.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.786 0.327 . . . . 0.0 111.21 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.6 t -154.36 148.87 26.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.663 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.578 HG23 ' CE1' ' A' ' 31' ' ' TYR . 5.7 pt -90.04 135.36 26.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.952 0.406 . . . . 0.0 111.232 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.502 HG13 ' CB ' ' A' ' 9' ' ' ALA . 44.6 t -141.98 139.35 18.01 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.602 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.517 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 9.9 Cg_endo -51.07 153.16 9.48 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.61 2.207 . . . . 0.0 112.248 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -126.17 -152.96 8.25 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.653 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.0 mp0 -34.05 139.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.562 0.745 . . . . 0.0 112.682 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' HG2' HG12 ' A' ' 27' ' ' VAL . 11.7 mt-30 -134.42 94.64 3.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.217 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.08 165.58 21.79 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.782 -0.723 . . . . 0.0 113.301 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.439 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -90.59 -19.94 23.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.587 0.232 . . . . 0.0 110.962 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.72 126.24 38.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.766 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.462 ' HD2' HD11 ' A' ' 49' ' ' ILE . 42.5 t80 -74.03 -16.64 61.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.889 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -51.33 -41.01 60.27 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.657 0.265 . . . . 0.0 111.043 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.01 -29.48 67.66 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.239 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.609 ' HE2' ' HB1' ' A' ' 60' ' ' ALA . 32.4 t80 -63.37 -45.36 91.53 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.716 0.293 . . . . 0.0 110.825 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.462 HD11 ' HD2' ' A' ' 45' ' ' TYR . 3.5 mt -69.13 -42.96 81.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.093 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -55.39 -47.08 76.4 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.483 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -75.94 -33.77 59.84 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.479 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -72.83 81.05 1.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.849 0.357 . . . . 0.0 111.332 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.3 p -107.45 144.92 33.7 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.565 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.05 65.85 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.347 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.799 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -157.83 38.86 0.27 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.417 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.799 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 161.95 163.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.252 0.621 . . . . 0.0 110.365 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.726 ' HB3' HG11 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -107.98 124.65 50.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.47 179.057 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 pp -147.94 145.28 28.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.089 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 97' ' ' ASP . 3.4 m-85 -90.59 166.59 13.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.609 ' HB1' ' HE2' ' A' ' 48' ' ' PHE . . . -153.78 172.33 17.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.134 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.572 ' HB3' HG22 ' A' ' 27' ' ' VAL . 1.5 t80 -152.31 138.47 18.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.2 t -143.52 137.65 25.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.003 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -102.86 127.64 49.97 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.662 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -117.04 159.19 22.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.902 0.382 . . . . 0.0 111.332 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.8 t -142.15 134.68 28.11 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.711 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 42.3 p -124.59 87.82 2.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.948 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.448 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.44 163.2 33.86 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.84 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -160.1 79.42 0.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.889 0.376 . . . . 0.0 111.143 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.79 33.61 1.58 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.352 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.6 ptp -151.37 -36.48 0.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.339 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.1 t -159.02 83.01 0.79 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.448 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -79.8 115.8 19.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.71 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.1 155.11 47.52 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.25 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -125.26 141.75 51.9 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -141.19 129.14 21.88 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.552 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 70.3 m-85 -85.3 141.1 30.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.66 114.13 17.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.732 HD11 HG11 ' A' ' 101' ' ' VAL . 0.5 OUTLIER -94.96 106.46 18.45 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.542 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.444 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 25.6 mm -103.15 115.22 44.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.438 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.459 HG21 HG22 ' A' ' 113' ' ' VAL . 5.2 t -109.16 110.66 21.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.324 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -86.5 140.08 30.27 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.509 HG23 ' HB3' ' A' ' 115' ' ' SER . 2.7 tt -128.16 84.57 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.352 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.508 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -67.62 116.95 8.3 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.889 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.0 mm-40 -33.54 -31.68 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.751 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.5 m-80 -73.58 36.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.454 0.57 . . . . 0.0 111.727 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.726 HG11 ' HB3' ' A' ' 57' ' ' ARG . 3.7 m -102.04 113.32 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 70.9 m -65.52 174.28 2.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.952 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -49.18 -45.99 34.37 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.933 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -47.81 80.58 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.674 0.273 . . . . 0.0 110.982 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -63.2 -37.72 88.33 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.106 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -50.66 71.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.775 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.96 72.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.542 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.617 ' HE2' HG23 ' A' ' 3' ' ' THR . 0.3 OUTLIER -56.57 -36.87 69.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.248 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.3 -47.5 85.17 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.832 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.85 -46.55 93.89 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.016 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.649 ' O ' HG22 ' A' ' 99' ' ' THR . 4.0 m -63.81 -33.12 74.96 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.784 0.326 . . . . 0.0 110.722 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.553 ' O ' HG23 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -69.78 -31.18 68.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -34.29 74.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.678 0.275 . . . . 0.0 110.897 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.649 HG22 ' O ' ' A' ' 96' ' ' THR . 7.4 t -83.68 -33.24 25.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.276 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 97' ' ' ASP . 21.1 mt -68.08 -47.76 67.38 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.809 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.732 HG11 HD11 ' A' ' 78' ' ' LEU . 37.9 t -68.74 -38.02 78.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.366 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -63.23 -39.46 94.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.704 0.287 . . . . 0.0 110.656 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -65.35 -50.61 64.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.971 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.868 HG13 HG23 ' A' ' 105' ' ' VAL . 14.9 p -71.22 -36.26 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.337 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.868 HG23 HG13 ' A' ' 104' ' ' VAL . 26.1 t -118.15 98.94 7.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.937 0.399 . . . . 0.0 110.837 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -100.95 -36.84 8.89 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.008 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -78.15 81.22 4.54 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 110.74 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -130.18 177.07 7.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.698 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -110.07 -52.58 2.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.112 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -154.95 143.77 20.78 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.894 0.378 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.528 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 13.4 pt-20 -148.06 126.53 12.39 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.529 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -143.79 168.01 20.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.39 . . . . 0.0 111.434 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.459 HG22 HG21 ' A' ' 80' ' ' THR . 4.7 t -107.09 130.08 59.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.466 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.632 HG22 ' H ' ' A' ' 116' ' ' ASP . 41.4 mm -127.51 148.27 32.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.132 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.509 ' HB3' HG23 ' A' ' 82' ' ' ILE . 47.7 p -138.14 30.94 2.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.992 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.632 ' H ' HG22 ' A' ' 114' ' ' ILE . 26.2 t70 -136.29 135.01 38.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.682 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.11 85.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.373 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -63.04 -47.68 81.99 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.479 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -69.71 -30.14 67.71 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.853 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -33.12 74.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.765 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -47.46 131.76 13.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.206 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -51.73 -32.63 31.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.884 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -58.19 -45.18 88.01 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.374 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -67.28 -47.34 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.012 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.87 -47.95 89.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -62.18 -41.76 98.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -45.44 93.26 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.727 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.45 -49.78 72.32 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -37.1 82.5 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.099 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -57.86 -39.53 77.97 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.948 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -60.49 -28.99 68.8 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.313 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -102.13 34.85 2.57 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.403 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -63.13 -23.71 66.38 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.369 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -127.95 -134.16 3.85 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.089 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -141.24 29.51 1.81 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.56 0.219 . . . . 0.0 111.448 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 51.42 35.94 15.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 111.416 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -83.82 -44.7 14.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.06 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -77.26 148.8 35.57 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.203 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -160.71 -64.07 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -136.37 17.16 3.17 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.631 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.6 p -100.21 49.41 0.91 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.83 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.91 179.72 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.666 0.27 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -123.51 84.0 2.21 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.445 ' O ' HD12 ' A' ' 36' ' ' ILE . 21.3 mttm -104.08 176.79 5.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.514 HD13 ' HA ' ' A' ' 101' ' ' VAL . 10.0 tt -118.16 123.84 72.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.7 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.468 ' HB3' HG12 ' A' ' 37' ' ' VAL . 7.3 t70 -67.4 111.01 3.82 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.424 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -45.36 88.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.33 -44.48 75.9 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.062 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.617 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.49 -54.9 29.03 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -58.19 -47.78 82.38 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.092 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -42.02 99.14 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.895 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.41 -49.42 74.56 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.837 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.447 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.79 -32.9 74.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.175 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -57.64 10.41 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.146 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -68.5 -31.32 70.49 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.572 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.5 -49.11 64.96 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.141 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 13' ' ' ALA . 59.2 t -71.0 -33.82 53.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.833 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -53.88 -35.58 61.73 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.988 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -67.94 126.76 30.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.259 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -97.14 40.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.244 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -139.8 32.11 2.24 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.948 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -138.9 26.98 2.44 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.863 0.331 . . . . 0.0 111.781 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . 48.29 32.1 3.0 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.426 HG23 ' HB2' ' A' ' 41' ' ' GLN . 12.5 p -111.45 131.69 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.777 0.322 . . . . 0.0 111.634 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.543 HG12 ' HA ' ' A' ' 43' ' ' ALA . 18.0 pt -129.48 -41.55 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.638 ' CB ' HG22 ' A' ' 62' ' ' VAL . 27.9 p-90 -121.69 159.84 25.72 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.965 0.412 . . . . 0.0 111.802 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.61 HG12 ' HB3' ' A' ' 41' ' ' GLN . 12.4 m -142.84 148.08 20.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.588 178.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.612 HG22 ' HZ3' ' A' ' 26' ' ' TRP . 1.5 t -120.05 115.46 23.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.477 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 9.3 m-85 -79.64 121.1 24.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.607 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.71 164.75 17.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.87 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -78.66 113.26 16.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.899 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -132.42 108.93 9.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.664 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.54 37.63 58.11 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.521 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 m 64.38 26.85 13.62 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.706 0.288 . . . . 0.0 111.198 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -146.47 153.32 40.3 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.939 0.399 . . . . 0.0 110.735 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.445 HD12 ' O ' ' A' ' 4' ' ' LYS . 3.0 mp -84.08 128.88 38.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.468 HG12 ' HB3' ' A' ' 6' ' ' ASP . 19.6 m -145.11 144.92 25.16 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.884 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.617 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 36.5 Cg_exo -57.26 149.46 64.2 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -130.35 -153.47 7.73 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 121.21 -0.519 . . . . 0.0 112.467 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.581 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.9 mp0 -23.96 132.64 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.791 0.836 . . . . 0.0 112.74 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.61 ' HB3' HG12 ' A' ' 27' ' ' VAL . 3.4 pt20 -134.13 98.86 4.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.158 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.77 164.69 25.18 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.467 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 23' ' ' ALA . . . -88.34 -21.12 24.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.609 0.242 . . . . 0.0 110.805 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.12 115.36 28.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.729 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -68.35 -17.69 64.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.407 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.47 -40.84 27.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.664 0.269 . . . . 0.0 110.695 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -37.48 87.56 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.999 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.626 ' HZ ' ' HB2' ' A' ' 60' ' ' ALA . 5.8 t80 -67.84 -39.57 83.82 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.06 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 53.7 mt -68.46 -48.09 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.992 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.97 -36.19 76.6 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.685 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -24.61 27.49 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.528 ' SG ' HD21 ' A' ' 120' ' ' LEU . 1.3 m -74.66 82.39 2.05 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.829 0.347 . . . . 0.0 111.456 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.2 p -92.19 171.64 8.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.259 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.453 ' HB3' ' HG3' ' A' ' 84' ' ' GLU . 7.6 m-20 -86.27 19.06 2.85 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.563 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.694 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -134.79 71.95 1.45 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.674 0.273 . . . . 0.0 110.564 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.694 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -174.66 -172.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 120.939 0.399 . . . . 0.0 111.533 -179.363 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.79 102.67 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.18 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -149.53 177.64 9.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.528 ' CD1' HG23 ' A' ' 80' ' ' THR . 28.0 m-85 -110.36 171.79 7.25 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.626 ' HB2' ' HZ ' ' A' ' 48' ' ' PHE . . . -151.26 164.17 37.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.394 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -153.82 108.89 3.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.828 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.638 HG22 ' CB ' ' A' ' 26' ' ' TRP . 13.0 t -119.38 139.28 47.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -93.47 105.12 17.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.454 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.529 ' CG ' HD22 ' A' ' 129' ' ' LEU . 23.7 m-85 -84.69 141.84 30.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -126.5 121.6 32.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.756 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.405 HG21 ' HG3' ' A' ' 130' ' ' LYS . 34.7 p -121.04 100.84 7.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.573 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.599 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -159.94 148.97 18.2 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.172 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.474 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.6 OUTLIER -99.29 -177.82 3.72 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.538 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.1 14.53 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.474 ' H ' ' C ' ' A' ' 68' ' ' ASP . 22.4 ptp -120.18 -34.95 3.55 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.486 0.315 . . . . 0.0 111.236 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 m -155.05 147.13 23.66 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 120.642 0.258 . . . . 0.0 110.982 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.599 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 3.5 pttm -124.97 142.59 51.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -137.17 144.23 42.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.74 149.61 31.42 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.122 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -138.88 139.54 38.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.753 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -104.77 123.57 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.878 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.633 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -136.64 136.01 38.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.15 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.429 HD21 ' HB3' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -107.33 106.59 17.1 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.379 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.413 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 2.0 mt -90.58 121.87 41.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.16 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.528 HG23 ' CD1' ' A' ' 59' ' ' PHE . 1.7 m -96.29 123.47 39.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.36 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.697 ' CE3' HD22 ' A' ' 120' ' ' LEU . 68.8 t-105 -111.13 134.38 52.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.891 0.377 . . . . 0.0 111.022 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 39.9 mt -137.75 105.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.031 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -68.84 116.57 7.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.624 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' HB3' ' A' ' 54' ' ' ASP . 0.1 OUTLIER -38.12 -30.34 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.657 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -72.94 36.24 0.08 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.031 0.444 . . . . 0.0 111.966 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.451 ' H ' ' C ' ' A' ' 84' ' ' GLU . 5.0 m -109.35 127.73 65.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.546 178.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.99 170.45 11.27 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.85 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.03 -42.17 47.38 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.672 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.4 -44.99 93.06 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.854 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -61.69 -41.73 97.97 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.878 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -61.23 -46.06 91.96 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.649 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.24 78.06 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.255 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -55.62 -55.05 36.56 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.856 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -38.55 71.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.58 -45.74 94.2 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.823 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.8 -45.37 36.43 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.668 0.234 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.887 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -59.76 -38.34 81.54 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.297 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -32.73 69.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.871 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.1 m -70.53 -42.73 70.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.441 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.887 HD12 ' HA ' ' A' ' 97' ' ' ASP . 6.4 mt -61.8 -50.07 73.81 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.084 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.514 ' HA ' HD13 ' A' ' 5' ' ' ILE . 13.0 p -62.65 -35.39 70.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.274 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -62.79 -41.79 99.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.714 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -62.83 -37.73 87.94 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.845 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 100' ' ' LEU . 39.7 t -63.79 -44.89 98.37 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.924 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -121.38 98.55 6.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -95.0 -24.85 16.74 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.555 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -80.16 83.65 5.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.787 0.327 . . . . 0.0 110.89 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -136.23 166.96 22.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.61 -55.35 2.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.318 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -132.74 147.65 52.32 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.288 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.429 ' HB3' HD21 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -152.0 124.58 8.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.992 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.611 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 13.4 p90 -158.55 161.1 37.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.382 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.455 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 8.7 p -109.31 140.39 28.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.781 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.587 HD11 ' HE1' ' A' ' 112' ' ' PHE . 8.5 mt -131.87 139.37 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 111.337 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.68 -26.24 10.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.947 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -83.9 138.67 33.05 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -35.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.525 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -68.19 -47.45 67.88 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.34 -27.9 68.25 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.204 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.697 HD22 ' CE3' ' A' ' 81' ' ' TRP . 1.3 tp -76.37 -28.48 56.79 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.6 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -50.59 135.17 23.39 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.102 0.477 . . . . 0.0 111.164 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.45 -31.65 46.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.121 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.38 -43.79 92.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.802 0.334 . . . . 0.0 110.599 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.38 -48.91 68.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.905 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.611 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 15.8 mt -61.96 -37.4 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.25 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.78 -40.49 63.24 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -73.08 -43.02 62.39 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.31 -49.41 74.1 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.185 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.633 HD11 ' CB ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -62.51 -45.47 92.85 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.271 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.405 ' HG3' HG21 ' A' ' 66' ' ' THR . 43.2 tttt -65.12 -33.21 75.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.889 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -54.18 -45.27 72.08 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.137 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.15 44.43 29.19 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.055 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.84 49.05 6.69 Favored Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.449 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -77.91 70.16 2.56 Favored Glycine 0 C--N 1.336 0.577 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.355 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -171.92 26.05 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -163.8 26.67 0.08 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.723 0.297 . . . . 0.0 111.082 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -55.69 -42.81 75.75 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.653 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -76.73 151.17 36.15 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.889 0.376 . . . . 0.0 111.267 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -152.87 -64.47 0.16 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.115 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -145.82 18.68 1.46 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.882 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 12.1 t -89.43 -42.04 11.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.034 -179.741 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.767 0.318 . . . . 0.0 111.316 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 m -132.74 113.81 13.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.577 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -103.78 157.61 16.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.487 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.459 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.1 tt -128.73 118.83 48.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.471 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -79.97 112.01 16.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.918 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -37.41 58.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -55.37 35.56 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.099 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.679 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -59.53 -49.61 77.11 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.141 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.81 -46.88 84.05 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.899 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtt-85 -62.35 -46.31 89.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.926 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.16 -45.25 79.74 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.796 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -63.07 -46.52 87.06 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -56.3 -42.24 77.24 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.908 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.413 ' HA ' HD22 ' A' ' 16' ' ' LEU . 0.3 OUTLIER -65.13 -43.35 92.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.077 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.588 HG21 HG21 ' A' ' 27' ' ' VAL . 26.3 t -71.38 -31.05 42.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.259 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -39.38 58.91 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.929 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -87.09 134.18 33.53 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.608 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -98.99 27.1 5.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.306 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.42 31.42 5.06 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.395 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.57 ' O ' HG23 ' A' ' 24' ' ' VAL . 4.9 t -133.79 23.89 3.96 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 53.9 29.31 9.68 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 22' ' ' SER . 23.6 t -114.46 132.16 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.746 0.308 . . . . 0.0 111.391 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.59 HG12 ' HA ' ' A' ' 43' ' ' ALA . 22.8 pt -129.67 -40.68 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.609 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.774 ' HB2' HG22 ' A' ' 62' ' ' VAL . 24.6 p-90 -123.74 154.24 39.76 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.879 0.371 . . . . 0.0 111.294 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.739 HG13 ' HG3' ' A' ' 41' ' ' GLN . 6.8 t -138.57 155.05 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.198 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.43 ' O ' ' N ' ' A' ' 39' ' ' GLY . 0.3 OUTLIER -98.63 169.91 9.17 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.545 179.246 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -150.91 95.87 2.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.995 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -122.01 170.03 10.24 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.969 0.414 . . . . 0.0 111.61 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -80.21 135.87 36.36 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.759 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.524 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.0 m-20 -153.7 116.52 4.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.09 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.83 40.29 75.22 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.928 -0.654 . . . . 0.0 113.014 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m 62.78 28.42 16.47 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.626 0.251 . . . . 0.0 111.494 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.5 t -156.0 149.1 24.39 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.6 mt -78.39 132.24 32.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.171 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.524 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 30.9 m -144.47 154.09 56.18 Favored Pre-proline 0 CA--C 1.531 0.217 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.679 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 36.5 Cg_endo -64.85 163.45 28.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.429 2.086 . . . . 0.0 112.306 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.18 -153.84 7.69 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.253 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.6 mp0 -36.13 141.74 0.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.739 ' HG3' HG13 ' A' ' 27' ' ' VAL . 8.1 mt-30 -135.71 111.71 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.85 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.75 168.11 34.85 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.543 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.59 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.08 -18.73 29.83 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.723 -0.239 . . . . 0.0 110.956 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.71 119.94 31.35 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.752 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.414 ' HD2' HD11 ' A' ' 49' ' ' ILE . 15.2 t80 -72.94 -23.11 60.64 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.611 ' HA ' HD12 ' A' ' 49' ' ' ILE . 15.8 tp60 -48.76 -37.33 18.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.637 0.256 . . . . 0.0 110.715 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -33.65 76.51 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.337 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.87 -42.54 63.57 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.687 0.28 . . . . 0.0 111.057 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 46' ' ' GLN . 9.6 mt -62.31 -40.55 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.137 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -69.2 -38.35 78.57 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.552 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.97 -42.73 60.04 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.44 -179.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 6.1 m -80.45 84.22 6.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.979 0.419 . . . . 0.0 111.803 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 p -96.89 161.8 13.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.551 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.489 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.5 m-20 -81.89 63.39 6.11 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.123 0.487 . . . . 0.0 111.299 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.744 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.8 t70 -170.08 43.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.741 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.744 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.1 150.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.525 -179.514 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.583 ' HD3' HG23 ' A' ' 94' ' ' THR . 0.0 OUTLIER -109.9 121.82 46.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.731 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.6 173.38 11.87 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -117.85 172.3 7.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.256 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.37 166.08 31.89 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.47 . . . . 0.0 111.667 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -144.77 112.21 6.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.824 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.774 HG22 ' HB2' ' A' ' 26' ' ' TRP . 17.5 t -126.14 137.14 58.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.932 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -119.45 124.95 47.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.59 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -111.99 161.8 16.05 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.266 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 m -139.3 113.69 8.99 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.375 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.3 t -121.88 146.05 47.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.067 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.4 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -148.31 169.43 28.96 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.135 -0.555 . . . . 0.0 112.542 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -114.69 79.06 1.22 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.899 0.38 . . . . 0.0 111.331 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 30.4 48.22 0.05 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 179.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 15.2 ptp -178.95 -35.42 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.679 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -148.33 123.56 10.2 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.782 0.325 . . . . 0.0 111.173 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.4 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -107.87 129.99 55.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.452 179.488 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -118.6 138.3 52.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.713 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.6 t -102.41 150.4 23.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -148.16 138.42 22.72 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.947 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -94.07 147.08 23.48 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.552 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.54 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -143.53 142.04 30.97 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.596 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.93 105.15 16.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.389 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 25.4 mm -93.16 113.05 27.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.199 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.463 ' HB ' HG22 ' A' ' 113' ' ' VAL . 15.3 m -98.77 114.15 26.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.608 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -100.35 137.73 38.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.857 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.527 ' CG2' HG21 ' A' ' 86' ' ' VAL . 40.0 mt -138.57 97.37 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.489 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.95 109.7 3.06 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.382 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 86' ' ' VAL . 36.9 mt-10 -22.23 -46.34 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -179.017 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.736 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.2 m-80 -70.72 43.68 0.07 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.14 0.495 . . . . 0.0 111.935 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.527 HG21 ' CG2' ' A' ' 82' ' ' ILE . 4.1 t -78.61 145.51 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.277 178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.0 m -83.71 171.28 13.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.02 7.08 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.409 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mp -58.97 -37.3 76.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.72 0.295 . . . . 0.0 110.964 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.69 -34.88 77.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -30.42 71.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.538 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -85.07 -39.0 18.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.975 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -33.82 67.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.302 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.583 HG23 ' HD3' ' A' ' 57' ' ' ARG . 3.0 p -64.62 -42.09 95.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.543 0.211 . . . . 0.0 110.736 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.48 -49.44 76.65 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.12 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -73.64 -30.2 62.8 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 111.505 0.187 . . . . 0.0 111.505 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.646 ' HA ' HD12 ' A' ' 100' ' ' LEU . 9.9 t0 -58.69 -42.73 89.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.7 0.286 . . . . 0.0 111.039 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -53.77 -32.73 53.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.128 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.9 m -74.98 -41.5 59.41 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.006 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 97' ' ' ASP . 16.8 mt -61.66 -49.23 77.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.364 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.501 ' HA ' HG12 ' A' ' 104' ' ' VAL . 58.6 t -64.65 -37.65 80.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.911 179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -61.85 -34.96 76.92 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.042 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -75.18 -47.5 28.03 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.442 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.793 HG13 HG23 ' A' ' 105' ' ' VAL . 13.7 p -66.54 -38.32 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.499 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.793 HG23 HG13 ' A' ' 104' ' ' VAL . 43.7 t -127.8 121.5 56.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 120.772 0.32 . . . . 0.0 110.967 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -120.17 3.29 10.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.961 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -89.43 74.55 7.75 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.913 0.387 . . . . 0.0 111.073 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -145.8 147.69 32.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.148 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.82 -41.85 15.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.372 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.55 ' HD2' HD22 ' A' ' 129' ' ' LEU . 0.1 OUTLIER -152.28 160.47 43.34 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.813 0.339 . . . . 0.0 111.181 -179.776 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -150.6 122.64 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.892 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -137.47 166.22 24.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 111.123 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.463 HG22 ' HB ' ' A' ' 80' ' ' THR . 25.5 t -110.37 139.57 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.631 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.527 HG22 ' H ' ' A' ' 116' ' ' ASP . 32.7 mm -131.53 151.1 34.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.105 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.1 t -147.1 29.8 0.97 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.017 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.527 ' H ' HG22 ' A' ' 114' ' ' ILE . 35.4 t70 -137.52 136.08 37.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.58 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.89 -35.91 82.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.289 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.8 tttm -65.9 -41.87 90.96 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.46 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -73.49 -33.11 64.66 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.59 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.428 ' HA ' HD23 ' A' ' 120' ' ' LEU . 5.0 mt -61.02 -34.15 74.39 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.432 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -43.43 130.31 5.03 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.333 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -49.69 -36.87 26.64 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.922 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -60.58 -42.6 97.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.893 0.378 . . . . 0.0 110.22 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -69.77 -49.71 50.37 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.952 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.4 mm -55.98 -46.51 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -66.81 -34.7 78.38 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.172 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.3 t -61.97 -48.81 78.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.828 0.347 . . . . 0.0 110.255 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.35 -32.21 71.15 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.712 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.55 HD22 ' HD2' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -53.44 -47.47 69.64 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.644 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -44.55 70.27 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.591 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.48 -43.32 77.18 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.735 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.416 ' HA ' ' CE2' ' A' ' 137' ' ' TYR . . . -73.47 89.36 1.66 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 111.183 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 97.16 39.32 4.05 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.54 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 135' ' ' ALA . . . -112.94 -86.93 1.59 Allowed Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.472 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 134' ' ' GLY . . . 176.07 32.06 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.621 0.248 . . . . 0.0 111.578 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -167.85 30.32 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 110.835 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.416 ' CE2' ' HA ' ' A' ' 132' ' ' ALA . 3.0 t80 -48.5 -39.41 23.1 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.832 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.76 155.98 39.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.807 0.337 . . . . 0.0 110.857 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -161.57 29.59 0.13 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -111.1 11.74 21.96 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.936 0.398 . . . . 0.0 111.384 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.2 p -146.33 38.15 1.04 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.775 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.798 0.332 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -133.99 130.89 38.27 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.735 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -107.98 103.22 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.69 HD12 ' HB ' ' A' ' 36' ' ' ILE . 0.9 OUTLIER -80.01 113.37 19.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.556 179.785 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.419 ' HB3' HG12 ' A' ' 37' ' ' VAL . 16.7 t0 -72.02 106.79 4.42 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HD3' HG23 ' A' ' 104' ' ' VAL . 1.3 mmmp? -68.26 -40.3 81.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.676 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -60.98 -45.95 92.73 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.752 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -59.65 -57.05 14.61 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.633 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 46.3 t -57.17 -42.83 81.84 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -41.99 96.27 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.906 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.76 -52.85 58.89 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.926 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.457 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.43 -33.46 76.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.158 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.526 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -55.96 -57.13 13.4 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.334 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -69.9 -29.81 67.09 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.618 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.46 -48.51 79.3 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.645 0.26 . . . . 0.0 111.128 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 13' ' ' ALA . 47.7 t -69.4 -33.74 58.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.45 -18.3 60.66 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.823 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -73.38 70.1 1.2 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 111.249 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.3 18.61 3.46 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.611 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 51.83 69.08 1.26 Allowed Glycine 0 C--N 1.339 0.736 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.465 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.464 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.5 t -71.53 78.4 0.79 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.901 0.381 . . . . 0.0 111.312 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 57.18 28.13 14.59 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.914 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 22' ' ' SER . 48.2 t -141.33 109.42 2.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.746 0.308 . . . . 0.0 110.849 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.41 HG12 ' HA ' ' A' ' 43' ' ' ALA . 2.2 pt -108.18 -28.84 2.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.542 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.563 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 43.9 p-90 -128.71 158.15 39.38 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.891 0.377 . . . . 0.0 111.312 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.619 HG12 ' HG2' ' A' ' 41' ' ' GLN . 29.2 m -142.34 143.99 25.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.154 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.561 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 3.6 m -82.38 168.09 17.86 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.472 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.452 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 7.7 m-85 -147.46 108.9 4.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 110.496 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -143.88 148.87 36.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 35' ' ' THR . 43.7 p90 -98.18 133.69 42.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.569 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.35 108.44 19.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.211 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.0 -71.37 2.21 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.123 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 p -159.8 33.71 0.18 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.205 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 3.3 t -145.47 126.39 14.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.69 ' HB ' HD12 ' A' ' 5' ' ' ILE . 33.3 mt -83.94 133.28 29.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.419 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.3 m -152.98 156.28 32.64 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.752 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.4 Cg_endo -65.86 160.05 45.88 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.6 2.2 . . . . 0.0 112.242 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.561 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.69 -146.67 6.09 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.494 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.563 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.29 137.32 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.083 0.553 . . . . 0.0 112.412 -179.185 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.619 ' HG2' HG12 ' A' ' 27' ' ' VAL . 35.5 mt-30 -135.22 114.44 12.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.329 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -149.99 160.94 28.72 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.757 -0.735 . . . . 0.0 113.338 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.41 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.12 -25.92 36.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.571 0.224 . . . . 0.0 110.815 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.42 121.37 38.15 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.511 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.92 -20.4 64.23 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -37.15 9.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.748 0.309 . . . . 0.0 111.042 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -42.96 99.48 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.678 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 56.4 t80 -66.88 -45.28 78.54 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.719 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 55.0 mt -61.42 -36.14 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -59.5 -47.06 86.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.016 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.88 -17.33 47.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.853 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.657 ' SG ' HD21 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -70.86 83.51 0.65 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.115 0.483 . . . . 0.0 111.592 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.2 p -111.09 146.21 37.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.458 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.516 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 2.3 m-20 -78.96 59.94 2.77 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.84 0.352 . . . . 0.0 111.699 -179.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.747 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.6 t70 -157.85 36.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.989 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.747 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -179.36 174.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.022 -179.759 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.569 ' HG2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -124.77 133.76 53.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.928 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.39 164.03 32.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.988 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.452 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 18.9 m-85 -105.87 166.19 10.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.925 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.678 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -143.87 155.52 44.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.578 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.449 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 1.2 t80 -152.07 135.53 16.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.503 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.21 141.93 12.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.855 0.36 . . . . 0.0 111.308 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD2' ' CE2' ' A' ' 76' ' ' PHE . 11.0 ttp180 -108.9 154.44 22.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.462 ' CD1' HD22 ' A' ' 129' ' ' LEU . 71.9 m-85 -125.47 150.47 47.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.1 m -146.8 99.98 3.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.656 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.6 p -105.21 91.26 3.72 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.925 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.477 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.31 161.7 32.74 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.823 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -158.83 79.94 0.78 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 111.237 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.41 36.92 1.79 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.215 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.0 ptm -155.03 -37.27 0.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.399 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.3 m -157.88 82.88 0.87 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.552 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.477 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.4 OUTLIER -79.78 100.48 7.97 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.598 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -113.45 125.3 54.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -109.66 146.26 35.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.67 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -139.83 143.63 36.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.156 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.48 ' CE2' ' HD2' ' A' ' 63' ' ' ARG . 5.5 m-85 -119.18 136.14 54.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.714 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -142.55 140.76 31.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.962 0.411 . . . . 0.0 111.718 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HG ' ' CD2' ' A' ' 61' ' ' PHE . 1.2 tt -109.15 119.66 40.2 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.241 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.451 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 2.2 mp -113.33 127.88 70.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 0.0 111.363 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.631 ' HB ' HG23 ' A' ' 113' ' ' VAL . 1.1 m -102.82 132.68 48.83 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.236 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.714 ' CE3' HD22 ' A' ' 120' ' ' LEU . 55.3 t-105 -109.36 123.96 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.902 0.382 . . . . 0.0 111.421 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.557 HD11 ' HD3' ' A' ' 91' ' ' ARG . 1.9 tt -114.91 100.32 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.861 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.516 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -71.35 73.2 0.75 Allowed Glycine 0 C--N 1.333 0.368 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.932 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 24.11 -75.22 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' A' ' 83' ' ' GLY . 49.5 m-80 -49.0 -18.06 0.26 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.548 HG21 HG13 ' A' ' 82' ' ' ILE . 16.7 t -36.75 109.24 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 O-C-N 123.229 0.33 . . . . 0.0 111.608 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.8 m -61.3 168.81 2.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.676 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.07 -48.25 86.83 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.467 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 89' ' ' LEU . 10.3 tp -57.34 -38.9 74.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.695 0.283 . . . . 0.0 110.533 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.569 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 24.5 mm-40 -68.73 -37.83 79.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.399 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.557 ' HD3' HD11 ' A' ' 82' ' ' ILE . 1.3 mmm180 -59.47 -51.45 69.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.431 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.53 87.71 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.94 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.98 -46.0 82.51 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.461 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 63.2 m -60.99 -44.46 97.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.72 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.22 -52.39 49.8 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.703 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.38 -37.43 85.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.59 0.233 . . . . 0.0 110.938 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.667 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.1 m-20 -57.91 -40.86 81.4 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.945 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -62.46 -29.75 70.75 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.015 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.6 m -67.79 -47.24 69.66 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.722 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' A' ' 97' ' ' ASP . 1.4 mt -61.98 -42.54 99.25 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.965 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 97' ' ' ASP . 41.0 t -67.96 -31.68 53.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.78 -41.12 96.09 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.932 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.45 -52.68 43.78 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.13 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.785 HG13 HG23 ' A' ' 105' ' ' VAL . 7.6 p -64.29 -34.27 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.3 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.785 HG23 HG13 ' A' ' 104' ' ' VAL . 41.1 t -119.29 89.92 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 120.912 0.387 . . . . 0.0 110.713 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -101.52 -24.37 14.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -77.63 84.17 4.0 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.923 0.392 . . . . 0.0 110.841 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.423 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.6 p90 -146.04 164.17 32.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.872 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.52 -47.7 8.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.169 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -165.18 161.86 19.67 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.135 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -150.6 138.89 20.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.789 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -147.0 168.52 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.978 0.418 . . . . 0.0 111.288 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.631 HG23 ' HB ' ' A' ' 80' ' ' THR . 8.8 p -119.15 139.33 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 113' ' ' VAL . 38.9 mm -129.69 151.96 36.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.987 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 14.9 m -109.94 -29.28 8.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.244 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -101.42 149.64 23.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.812 0.339 . . . . 0.0 110.872 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -69.44 -21.28 63.74 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.884 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -61.79 -57.74 10.68 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.114 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -75.19 -22.34 58.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.582 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.714 HD22 ' CE3' ' A' ' 81' ' ' TRP . 3.6 tp -80.23 -25.7 39.46 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.737 -0.21 . . . . 0.0 111.066 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -52.77 144.75 13.62 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.288 0.566 . . . . 0.0 111.667 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -53.38 -33.36 53.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.603 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -41.0 85.4 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.91 0.386 . . . . 0.0 110.446 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -71.34 -45.23 63.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.88 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.478 HG22 HD13 ' A' ' 129' ' ' LEU . 42.7 mt -61.32 -49.09 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.954 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -33.52 70.72 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.284 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.6 t -79.23 -43.95 22.78 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -63.07 -45.67 91.06 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.169 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.714 HD21 ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -68.28 -23.81 64.8 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.665 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 20.4 tttm -50.88 -42.91 59.42 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.613 0.244 . . . . 0.0 111.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.02 -66.55 0.88 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.477 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 51.79 34.01 12.34 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.719 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 161.0 53.3 0.02 OUTLIER Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.623 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -92.84 -126.17 4.02 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.232 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -143.81 23.85 1.71 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.5 0.191 . . . . 0.0 111.502 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 50.63 31.85 6.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.524 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.16 -56.39 2.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.898 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -79.6 142.35 35.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.976 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -114.15 -35.66 4.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.449 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.7 14.65 9.87 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.904 0.383 . . . . 0.0 111.634 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 3.9 m -144.61 41.48 1.33 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.608 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.949 -179.923 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.819 0.342 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 34' ' ' SER . 28.0 m -78.08 101.2 6.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.514 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 35' ' ' THR . 9.2 mttp -95.13 169.79 9.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.822 HD12 HD12 ' A' ' 36' ' ' ILE . 3.4 tt -129.33 124.87 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.576 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.33 106.11 5.81 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.645 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -39.05 84.65 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.754 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -52.52 64.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.957 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -66.8 -52.96 37.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.293 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.2 m -53.11 -46.96 68.94 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.27 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -65.14 -41.67 94.55 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.716 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.52 75.01 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.665 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.88 99.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.77 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.668 ' HE2' HG13 ' A' ' 105' ' ' VAL . 4.3 t80 -59.25 -42.11 90.35 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.979 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -66.52 -41.46 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.065 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 tp -71.28 -48.27 51.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.639 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.08 -29.51 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.336 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -61.19 -34.15 74.61 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.624 0.249 . . . . 0.0 110.703 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.56 100.48 1.82 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -6.79 59.62 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.38 -32.12 62.7 Favored Glycine 0 C--N 1.338 0.661 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.876 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.6 t -87.26 175.35 8.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.922 0.391 . . . . 0.0 111.455 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.63 54.79 2.97 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.31 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.5 t -132.17 98.53 3.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.703 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -104.61 -30.93 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 30.4 p-90 -132.28 157.97 43.02 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.881 0.372 . . . . 0.0 111.582 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -141.63 149.27 20.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.466 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.526 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 90.3 m -88.93 162.47 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.893 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.413 ' N ' HG22 ' A' ' 28' ' ' THR . 9.8 m-85 -148.23 96.41 2.62 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.811 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -123.67 152.56 41.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.452 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -105.56 118.07 35.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.95 0.405 . . . . 0.0 111.054 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.11 90.55 0.87 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.43 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.45 -57.52 4.12 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.491 ' O ' HG23 ' A' ' 3' ' ' THR . 1.7 t -149.66 -35.62 0.17 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 11.3 t -80.28 130.32 35.12 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.924 0.393 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.822 HD12 HD12 ' A' ' 5' ' ' ILE . 33.0 mt -79.29 141.01 15.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.08 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.542 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.5 p -158.59 138.31 8.59 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.049 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 19.4 Cg_endo -59.6 162.61 14.81 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.68 2.253 . . . . 0.0 112.378 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.526 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -131.54 -150.83 6.76 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 121.25 -0.5 . . . . 0.0 112.712 -179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.548 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -38.72 141.44 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.242 0.617 . . . . 0.0 112.47 -179.037 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -139.32 98.83 3.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.142 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.83 165.86 23.76 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.332 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.491 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.1 -21.92 25.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.627 0.251 . . . . 0.0 110.865 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -97.28 128.06 43.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.536 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -73.95 -20.13 60.46 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.652 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.521 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -48.21 -40.74 25.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.828 0.347 . . . . 0.0 110.36 179.46 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -39.38 88.23 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.263 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.569 ' HZ ' ' HB2' ' A' ' 60' ' ' ALA . 6.4 t80 -69.03 -45.22 71.02 Favored 'General case' 0 C--N 1.338 0.066 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.736 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 46' ' ' GLN . 26.7 mt -57.4 -40.54 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.324 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -68.04 -39.53 83.03 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.03 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -89.98 0.03 57.32 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.5 t -110.03 87.4 2.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.88 0.372 . . . . 0.0 111.425 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.33 176.77 5.59 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.448 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.84 19.58 1.68 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -133.07 75.68 1.64 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.714 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.21 -172.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.837 0.351 . . . . 0.0 111.813 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -166.62 96.31 0.55 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.365 179.725 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 pp -151.92 173.31 14.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.443 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -107.06 163.71 12.76 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.134 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HB2' ' HZ ' ' A' ' 48' ' ' PHE . . . -143.11 161.42 38.24 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.022 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -148.05 126.94 12.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -134.99 138.5 48.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.185 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -102.02 106.4 17.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.497 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -108.92 140.0 43.0 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.994 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.466 HG23 ' C ' ' A' ' 73' ' ' ARG . 42.4 m -139.39 133.78 31.53 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.928 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.7 p -113.3 89.41 3.07 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.821 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.435 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.29 169.39 36.11 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.845 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -159.87 79.42 0.7 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 111.115 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.99 34.86 2.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.522 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.0 ptt? -152.24 -37.61 0.11 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.389 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.6 t -158.08 85.93 0.89 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.236 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.435 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -79.69 105.27 10.86 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.041 -179.51 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.466 ' C ' HG23 ' A' ' 65' ' ' THR . 0.6 OUTLIER -103.47 88.27 3.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.834 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p -91.98 135.23 34.11 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.139 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -146.54 146.23 30.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.4 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 34.2 m-85 -99.95 130.79 46.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.417 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.596 ' HB2' HD12 ' A' ' 129' ' ' LEU . . . -122.75 127.03 48.65 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.292 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.0 tt -100.94 107.2 18.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.382 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.586 ' CG2' HD12 ' A' ' 114' ' ' ILE . 3.1 mt -99.83 105.03 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.503 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.9 p -88.95 116.53 27.31 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.847 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.418 ' HZ3' HG22 ' A' ' 114' ' ' ILE . 74.9 t-105 -100.25 140.57 34.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.078 0.465 . . . . 0.0 111.82 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 mt -144.57 101.2 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.653 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.33 124.52 9.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.261 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -33.07 -46.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.722 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.0 m-80 -56.05 -10.92 0.92 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -51.98 125.68 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.998 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.09 162.84 28.58 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.64 -50.7 52.61 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.813 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.29 -39.51 87.16 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.772 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.481 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 71.6 mm-40 -61.95 -44.58 96.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -57.06 -48.12 79.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.743 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.41 -44.72 89.16 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.647 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -56.58 -54.58 44.28 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.291 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -48.74 -40.17 27.61 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.489 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.26 -52.37 53.0 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.963 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.719 ' O ' HG22 ' A' ' 99' ' ' THR . 0.6 OUTLIER -62.5 -37.48 86.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.305 . . . . 0.0 110.786 179.257 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.481 ' O ' HG23 ' A' ' 101' ' ' VAL . 22.6 m-20 -70.06 -35.7 74.42 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.195 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -31.79 71.94 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.299 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 96' ' ' THR . 7.0 t -81.02 -33.33 33.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.951 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.449 ' O ' HG23 ' A' ' 104' ' ' VAL . 36.0 mt -64.22 -43.81 93.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 97' ' ' ASP . 39.6 t -68.02 -42.53 85.38 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -37.41 76.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.0 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.12 -42.51 93.87 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.761 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 100' ' ' LEU . 43.4 t -69.58 -41.34 80.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.909 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.668 HG13 ' HE2' ' A' ' 14' ' ' TYR . 36.3 t -114.1 97.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.949 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -96.18 -22.24 17.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.567 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.6 80.44 5.98 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.965 0.412 . . . . 0.0 110.514 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -129.27 172.91 11.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.734 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -117.34 -53.95 2.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.531 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.1 125.57 13.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.776 0.322 . . . . 0.0 111.494 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.43 128.35 47.95 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.557 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.408 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 4.4 p90 -144.1 161.75 38.01 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.987 0.422 . . . . 0.0 111.514 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.6 t -100.81 141.99 16.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.392 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.586 HD12 ' CG2' ' A' ' 79' ' ' ILE . 31.7 mt -135.94 135.78 50.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 21.3 t -118.58 -15.98 9.51 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.991 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -115.0 151.89 33.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 111.03 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -21.96 66.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.354 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -55.8 22.11 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.576 0.227 . . . . 0.0 110.792 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.475 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 0.6 OUTLIER -73.88 -30.03 62.4 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.542 ' N ' HG21 ' A' ' 114' ' ' ILE . 0.9 OUTLIER -68.72 -25.85 64.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.689 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.04 136.98 56.32 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -53.21 -29.94 34.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.924 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -59.91 -47.16 86.92 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.945 0.402 . . . . 0.0 110.425 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.475 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 30.8 t80 -68.21 -48.36 65.42 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.862 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.408 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 59.6 mt -54.61 -43.74 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -43.29 80.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.179 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -47.54 76.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.819 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.63 -42.83 97.7 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.118 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.596 HD12 ' HB2' ' A' ' 77' ' ' ALA . 5.2 tt -70.23 -31.97 69.63 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.249 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -60.63 3.3 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.738 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.3 mtpt -99.24 -53.43 3.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 60.66 33.09 20.36 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.664 0.269 . . . . 0.0 111.379 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.05 55.88 0.25 Allowed Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.629 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.49 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . -178.18 173.18 45.7 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 121.215 -0.517 . . . . 0.0 112.395 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 76.34 18.58 1.82 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 111.627 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -152.72 24.24 0.59 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.821 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -65.17 -57.42 8.6 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.542 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -100.02 156.87 16.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.873 0.368 . . . . 0.0 111.269 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -103.42 -25.85 13.11 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.091 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -91.62 10.85 26.39 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 34.1 m -118.49 -39.05 3.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.095 -0.955 . . . . 0.0 111.126 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.694 0.283 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 t -128.4 147.31 50.64 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' O ' ' HA ' ' A' ' 35' ' ' THR . 12.2 mttp -99.51 151.42 21.17 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.065 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.511 HG13 ' HB ' ' A' ' 36' ' ' ILE . 3.8 tt -116.71 128.96 73.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.37 106.67 16.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -58.57 -37.34 75.54 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.215 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.27 -49.81 76.41 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.912 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.86 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.56 -53.89 44.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.307 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' HG11 ' A' ' 104' ' ' VAL . 1.7 t -53.54 -43.04 68.09 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.187 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -68.78 -43.07 76.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.64 -45.97 73.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.697 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -64.52 -48.39 75.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.84 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -53.39 -46.57 69.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.855 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -57.52 -43.52 84.36 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.019 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.28 -40.84 81.72 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.077 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 13' ' ' ALA . 42.8 t -64.69 -42.01 93.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.842 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.6 -41.27 80.9 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.631 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -70.68 124.35 24.07 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.641 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -99.81 30.44 3.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.492 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -136.51 32.39 2.48 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.759 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.631 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -130.96 24.55 4.96 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.852 0.326 . . . . 0.0 111.776 -179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . 54.75 28.7 10.57 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 22' ' ' SER . 42.9 t -124.89 114.31 39.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 111.22 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.466 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -107.41 -30.16 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.434 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -131.27 154.87 48.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.878 0.371 . . . . 0.0 111.173 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.514 ' CG1' HG22 ' A' ' 17' ' ' VAL . 34.2 m -142.17 146.77 22.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.261 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.22 170.71 9.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.995 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -148.56 98.96 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.36 179.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.26 -179.57 3.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.013 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 35.2 p90 -140.8 128.56 21.67 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.023 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.44 ' O ' HG22 ' A' ' 35' ' ' THR . 1.1 t70 -96.9 107.16 19.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.397 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.59 -77.56 1.07 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.161 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.72 38.31 0.47 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.753 0.311 . . . . 0.0 111.359 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.44 HG22 ' O ' ' A' ' 32' ' ' ASP . 2.6 t -140.77 122.73 15.52 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.898 0.38 . . . . 0.0 110.987 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.511 ' HB ' HG13 ' A' ' 5' ' ' ILE . 4.0 mm -79.47 133.44 29.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.94 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.564 HG23 ' HB1' ' A' ' 9' ' ' ALA . 9.8 p -157.09 139.0 10.11 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.005 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.86 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 15.6 Cg_endo -56.34 162.75 7.39 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.61 2.207 . . . . 0.0 112.329 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -127.06 -157.96 9.66 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.387 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.5 mp0 -32.63 139.11 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.782 0.833 . . . . 0.0 112.611 -179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.464 ' HB3' HG11 ' A' ' 24' ' ' VAL . 22.3 mt-30 -136.4 91.78 2.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.408 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.18 168.5 21.44 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 113.317 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.466 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -94.21 -15.23 24.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.754 -0.223 . . . . 0.0 111.187 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -96.72 129.61 44.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -78.42 -17.09 56.88 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.717 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -49.76 -40.57 41.61 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.765 0.317 . . . . 0.0 110.601 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.91 -36.17 81.65 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.928 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.525 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 8.1 t80 -60.7 -46.7 89.38 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.761 0.315 . . . . 0.0 110.788 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 25.1 mt -63.94 -41.47 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -70.42 -40.05 74.07 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.715 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.16 -42.01 69.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.535 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -73.71 81.91 1.57 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.921 0.391 . . . . 0.0 111.265 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 p -117.4 155.83 28.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.56 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.479 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 7.2 m-20 -72.33 69.53 0.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.203 0.525 . . . . 0.0 110.95 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.734 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.5 t70 -170.03 46.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.098 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.668 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.66 -171.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.885 0.374 . . . . 0.0 111.935 -178.457 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.755 ' HB3' HG12 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -160.99 94.51 1.02 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.565 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 177.11 11.58 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.849 0.357 . . . . 0.0 111.675 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.741 ' CD2' HG23 ' A' ' 80' ' ' THR . 28.7 m-85 -109.74 163.43 13.51 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.462 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.525 ' HB1' ' CE2' ' A' ' 48' ' ' PHE . . . -147.42 141.48 26.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.084 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.537 ' HE1' HD12 ' A' ' 78' ' ' LEU . 1.5 t80 -122.39 135.42 54.69 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.021 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -137.24 136.17 47.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.179 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -101.76 127.1 48.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.826 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -107.56 151.22 25.89 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.184 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.73 128.43 20.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.0 p -141.72 131.23 23.85 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.447 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -153.61 137.85 5.98 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.169 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -133.5 137.58 45.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.5 -0.35 . . . . 0.0 110.248 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 70' ' ' MET . . . 61.68 30.6 18.56 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.234 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 0.7 OUTLIER 83.74 1.45 0.98 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.435 179.768 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.435 ' O ' ' HA2' ' A' ' 67' ' ' GLY . 0.3 OUTLIER -95.12 83.46 3.92 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.89 0.376 . . . . 0.0 110.75 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.447 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 2.2 ttpm? -86.0 140.5 30.25 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.299 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -145.97 114.84 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.42 151.76 23.75 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.695 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -137.9 144.03 41.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.891 0.377 . . . . 0.0 111.402 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.563 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 3.6 m-85 -94.0 134.99 35.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.795 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -135.95 106.27 6.41 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.892 0.377 . . . . 0.0 111.429 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.537 HD12 ' HE1' ' A' ' 61' ' ' PHE . 7.7 tt -96.35 117.05 30.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.41 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.413 HG21 ' CD2' ' A' ' 120' ' ' LEU . 2.1 mp -118.87 119.94 62.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 120.878 0.37 . . . . 0.0 111.345 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.741 HG23 ' CD2' ' A' ' 59' ' ' PHE . 1.5 m -88.08 138.58 31.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.235 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.668 ' CE3' HD12 ' A' ' 120' ' ' LEU . 52.5 t-105 -115.54 125.98 53.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.912 0.387 . . . . 0.0 111.192 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.668 HG13 HG11 ' A' ' 86' ' ' VAL . 3.3 tt -123.59 81.4 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.523 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.546 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -62.48 126.05 36.89 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.572 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -29.62 -34.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.734 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.7 m-80 -73.93 39.64 0.11 Allowed 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.135 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.755 HG12 ' HB3' ' A' ' 57' ' ' ARG . 4.7 m -96.46 112.08 27.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.505 178.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.9 170.15 16.8 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.154 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -46.03 -50.65 12.04 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.493 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.67 -35.94 81.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.625 0.212 . . . . 0.0 111.513 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.465 ' HG3' ' HG3' ' A' ' 57' ' ' ARG . 3.0 mp0 -65.09 -39.93 93.87 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.997 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -50.68 -50.42 54.88 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.837 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.22 -38.58 68.96 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -55.33 -40.68 71.48 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.366 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.5 m -53.26 -46.91 69.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.151 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.06 -50.4 65.78 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.001 -0.618 . . . . 0.0 112.624 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.5 p -62.66 -41.22 98.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.562 0.22 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -66.64 -40.87 88.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.09 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -30.21 68.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.772 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.5 m -71.9 -42.68 66.46 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.774 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -56.52 -56.07 25.88 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.19 -36.55 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.963 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -45.1 89.94 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.907 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.07 -38.05 84.86 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.554 HG11 ' SG ' ' A' ' 10' ' ' CYS . 20.3 t -73.74 -43.54 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.35 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.89 100.25 10.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.926 0.393 . . . . 0.0 111.118 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -103.47 -29.34 11.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.573 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.78 83.81 4.9 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.14 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -138.19 -179.14 5.61 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.736 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -109.6 -67.19 1.0 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.387 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -134.87 144.57 47.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.41 137.05 43.74 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.582 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 8.7 p90 -155.66 173.98 15.95 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.101 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.535 HG23 ' HB ' ' A' ' 80' ' ' THR . 9.9 p -124.41 141.01 45.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.404 HD12 ' HB3' ' A' ' 119' ' ' GLU . 30.8 mm -126.22 153.37 34.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.15 -179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 m -117.59 -24.74 7.16 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -117.81 146.81 43.58 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.941 0.4 . . . . 0.0 111.168 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -62.57 -28.04 69.6 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.594 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.87 -45.76 91.47 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.667 0.27 . . . . 0.0 110.886 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.404 ' HB3' HD12 ' A' ' 114' ' ' ILE . 1.8 mt-10 -77.55 -31.5 53.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.8 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.841 HD23 HD11 ' A' ' 125' ' ' ILE . 0.4 OUTLIER -79.76 -2.23 42.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.732 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.07 132.23 53.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.931 0.396 . . . . 0.0 110.523 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.39 -37.76 49.93 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.609 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.5 -43.1 99.46 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.28 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -67.94 -51.54 46.43 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.834 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.841 HD11 HD23 ' A' ' 120' ' ' LEU . 63.7 mt -57.71 -50.44 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -55.05 -42.09 72.27 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.185 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -40.69 94.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.045 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -63.14 -56.8 13.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.577 HD23 HG22 ' A' ' 125' ' ' ILE . 2.8 pp -63.81 -23.54 67.4 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.609 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -82.47 -29.38 30.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.421 0.153 . . . . 0.0 110.911 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.41 -55.22 4.44 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -131.98 44.51 2.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.88 0.371 . . . . 0.0 111.531 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -120.68 30.29 5.58 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.44 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -154.69 -101.62 0.2 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.505 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -166.15 41.16 0.06 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.653 0.264 . . . . 0.0 111.398 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 46.76 44.38 14.0 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 111.229 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -65.89 -49.76 66.91 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.225 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -95.46 148.76 22.13 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.028 0.442 . . . . 0.0 111.134 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -147.15 -66.42 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.706 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -141.56 18.19 2.19 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.552 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 13.0 t -121.85 37.98 4.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.324 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.355 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.77 0.319 . . . . 0.0 111.282 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 t -136.29 143.66 44.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.694 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -179.55 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.565 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.567 ' HB ' HD12 ' A' ' 36' ' ' ILE . 2.5 tt -130.72 133.32 63.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.747 0.308 . . . . 0.0 111.16 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -83.13 96.17 8.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.37 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -59.83 -42.92 94.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.244 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.98 -49.81 74.62 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.323 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.429 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -70.27 -50.94 34.49 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 40.8 m -55.35 -42.9 74.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -66.11 -47.23 74.85 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.516 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.28 -44.19 71.68 Favored 'General case' 0 CA--C 1.527 0.06 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.894 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.528 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -66.62 -37.48 84.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.252 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -55.13 -60.07 3.89 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.15 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -63.96 -29.48 70.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.526 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.947 HD23 HG11 ' A' ' 24' ' ' VAL . 4.0 tt -62.55 -44.54 96.07 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.714 0.293 . . . . 0.0 110.603 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 13' ' ' ALA . 52.3 t -68.2 -34.63 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.58 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -60.3 -35.99 76.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.72 123.59 25.2 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.412 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.02 41.99 1.11 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.321 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.26 24.16 3.11 Favored Glycine 0 CA--C 1.521 0.458 0 C-N-CA 120.841 -0.695 . . . . 0.0 113.153 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.46 27.32 2.81 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 117.053 0.427 . . . . 0.0 111.74 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . 48.08 34.96 4.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.485 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.947 HG11 HD23 ' A' ' 16' ' ' LEU . 14.2 p -118.34 117.77 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.519 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.684 HD12 HG13 ' A' ' 62' ' ' VAL . 1.1 pt -121.57 -31.56 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.538 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 32.2 p-90 -130.87 158.42 40.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.951 0.405 . . . . 0.0 111.384 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.769 HG12 ' HG2' ' A' ' 41' ' ' GLN . 14.5 m -144.52 145.18 21.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.23 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.495 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 16.7 p -105.7 100.23 9.8 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.812 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' A' ' 59' ' ' PHE . 3.8 m-85 -78.89 109.62 13.34 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.666 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -128.45 135.58 49.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.593 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -91.69 123.7 35.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.98 123.33 45.69 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.715 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.1 -83.04 0.74 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.357 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.94 31.06 0.56 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.5 t -149.82 139.22 21.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.744 0.307 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.567 HD12 ' HB ' ' A' ' 5' ' ' ILE . 7.0 mt -85.09 137.77 20.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.901 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.415 HG23 ' CB ' ' A' ' 9' ' ' ALA . 10.0 p -155.15 141.26 12.96 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.499 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.439 ' HG3' ' CZ ' ' A' ' 29' ' ' PHE . 37.8 Cg_exo -57.56 154.34 36.92 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.555 2.17 . . . . 0.0 112.515 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -128.45 -155.74 8.75 Favored Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 121.325 -0.464 . . . . 0.0 112.082 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.5 mp0 -24.52 130.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.727 0.811 . . . . 0.0 112.643 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.769 ' HG2' HG12 ' A' ' 27' ' ' VAL . 31.0 mt-30 -131.69 98.13 4.4 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.32 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.85 164.33 24.98 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.482 -0.866 . . . . 0.0 113.32 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.596 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -89.67 -20.66 23.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.62 0.248 . . . . 0.0 110.889 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.81 126.49 37.91 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.795 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 12.9 t80 -70.79 -19.13 62.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.671 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -46.98 -41.94 17.12 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.745 0.307 . . . . 0.0 110.643 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.89 -36.68 82.83 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.937 178.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -58.68 -49.34 77.93 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.099 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.3 mt -70.85 -42.61 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.67 -45.43 94.16 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.027 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -76.39 -31.01 57.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.8 m -75.29 84.55 2.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.056 0.455 . . . . 0.0 111.5 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p -93.17 169.67 10.22 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.15 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -85.46 17.43 3.19 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.721 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -133.67 67.86 1.51 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.296 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.721 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -177.35 -172.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.386 -179.096 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.746 ' HD3' HG12 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -159.06 114.91 2.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.778 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 pp -158.31 154.06 26.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.827 0.346 . . . . 0.0 111.537 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 1.5 m-85 -107.05 98.98 8.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.407 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -107.92 157.41 18.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.767 ' HB3' HD23 ' A' ' 78' ' ' LEU . 31.7 p90 -152.37 164.29 37.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.262 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.684 HG13 HD12 ' A' ' 25' ' ' ILE . 4.4 t -137.41 152.54 27.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.364 -179.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -113.26 104.11 12.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.633 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -103.7 173.33 6.35 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.44 114.05 19.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.274 179.35 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -89.18 91.55 8.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.425 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.6 178.26 36.68 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.784 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -159.7 79.45 0.71 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.896 0.379 . . . . 0.0 111.247 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 42.68 39.58 1.69 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.499 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.57 -36.18 0.06 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.611 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.5 m -156.58 81.75 0.96 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.819 0.342 . . . . 0.0 110.947 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.425 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 14.8 pttm -83.51 102.06 11.86 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.844 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -105.56 133.29 50.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.63 135.68 33.69 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.839 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.426 ' HD3' ' HB1' ' A' ' 109' ' ' ALA . 24.5 mttm -151.73 146.33 25.68 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.953 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.595 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 76.1 m-85 -92.98 170.68 9.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.116 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.666 ' HB2' ' CD1' ' A' ' 129' ' ' LEU . . . -154.87 105.54 2.58 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.767 HD23 ' HB3' ' A' ' 61' ' ' PHE . 7.4 mt -80.99 134.64 35.73 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.203 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.514 ' CG2' HD12 ' A' ' 114' ' ' ILE . 21.4 mt -129.8 105.43 12.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.027 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.864 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.3 OUTLIER -80.23 97.04 6.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.208 179.601 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.41 ' CZ3' HD12 ' A' ' 120' ' ' LEU . 71.2 t-105 -89.22 135.03 33.79 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 41.4 mt -141.58 101.4 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.78 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.68 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -68.08 117.06 8.17 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.026 -0.606 . . . . 0.0 112.221 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.2 mt-10 -32.04 -40.3 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -179.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.709 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.0 m-80 -71.28 42.0 0.07 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 111.942 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.746 HG12 ' HD3' ' A' ' 57' ' ' ARG . 2.7 m -95.49 135.2 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.491 178.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.16 164.49 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.47 83.47 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.024 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 tp -66.46 -32.14 73.32 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.622 0.211 . . . . 0.0 111.317 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -59.25 -40.21 85.25 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.959 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -40.45 80.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.18 -39.36 40.99 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -58.45 -46.32 86.79 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.011 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -42.28 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.193 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.43 -46.65 93.57 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.191 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.1 -43.13 68.32 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.646 0.26 . . . . 0.0 110.837 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.646 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.7 m-20 -61.6 -38.79 88.88 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.422 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.73 -30.62 70.09 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.681 0.277 . . . . 0.0 110.664 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 23.3 m -71.54 -41.82 68.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.412 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 97' ' ' ASP . 8.7 mt -63.33 -51.24 66.81 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.39 -30.58 49.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.312 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -65.55 -45.12 84.61 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.638 0.256 . . . . 0.0 110.676 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -38.69 81.99 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.831 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 26.2 t -78.26 -37.04 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.971 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -129.8 83.31 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.94 0.4 . . . . 0.0 110.751 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.0 -35.63 7.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.196 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.97 77.83 2.85 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -124.73 179.39 5.0 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -92.17 -59.36 2.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.5 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.85 154.29 51.22 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.751 0.31 . . . . 0.0 111.359 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -148.88 135.6 19.7 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.174 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.662 ' HE2' HD11 ' A' ' 114' ' ' ILE . 13.7 p90 -160.44 159.32 30.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.927 0.394 . . . . 0.0 111.292 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.864 HG12 ' HB ' ' A' ' 80' ' ' THR . 2.6 m -100.3 147.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.992 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.662 HD11 ' HE2' ' A' ' 112' ' ' PHE . 59.6 mt -142.18 140.62 29.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.956 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 54.6 m -140.49 31.57 1.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.413 ' H ' HG22 ' A' ' 114' ' ' ILE . 33.1 t70 -145.8 134.57 22.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.488 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -34.06 74.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.948 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -69.08 -41.09 78.0 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.681 0.277 . . . . 0.0 110.485 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.71 -32.85 64.11 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.666 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.41 HD12 ' CZ3' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -69.12 -24.94 64.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.577 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.91 135.2 12.66 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.045 0.45 . . . . 0.0 111.336 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -50.79 -33.74 24.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.094 -179.538 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -38.34 73.22 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 110.309 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -76.14 -46.2 29.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.714 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.497 HG21 HD11 ' A' ' 79' ' ' ILE . 29.3 mm -60.19 -51.47 72.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.225 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.0 -42.79 95.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.684 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.1 t -62.78 -43.36 99.01 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.571 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.02 -42.44 90.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.092 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.666 ' CD1' ' HB2' ' A' ' 77' ' ' ALA . 2.2 tp -64.42 -43.14 95.29 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.446 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 32.7 tttp -63.92 -46.71 83.59 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.26 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -73.55 -50.9 19.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.146 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.36 41.3 32.05 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.311 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 70.51 43.76 60.22 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.535 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -83.4 158.96 36.43 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.351 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -102.78 25.81 8.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.511 0.196 . . . . 0.0 111.2 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 50.85 47.15 25.14 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 120.909 0.385 . . . . 0.0 110.955 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.42 -55.97 27.14 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.522 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -86.19 159.46 19.48 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.205 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -171.47 -62.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.989 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -114.15 17.07 17.93 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.714 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 2.6 m -90.5 55.88 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.953 0.406 . . . . 0.0 110.894 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.943 179.891 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 67.32 118.59 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.142 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -88.62 150.81 22.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.072 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 tt -120.86 124.3 72.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.596 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.08 112.92 9.57 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.911 0.386 . . . . 0.0 110.806 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -72.24 -42.97 65.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.925 -179.834 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -57.06 -51.45 69.22 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.019 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.729 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.15 -50.78 71.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.3 t -57.35 -44.24 84.13 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.211 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -65.78 -42.0 91.31 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.35 -47.91 68.97 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.747 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.17 84.6 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.666 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -59.26 -37.58 77.95 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.124 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -69.98 -44.25 69.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.284 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -46.88 67.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.102 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.92 -24.91 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.39 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -39.84 66.68 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.881 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.39 114.52 6.15 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.571 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -95.55 42.16 1.09 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.235 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.66 31.73 2.37 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.719 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 t -137.82 177.54 7.8 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.842 0.353 . . . . 0.0 111.1 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.34 55.03 3.32 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.04 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.547 HG11 ' CD ' ' A' ' 41' ' ' GLN . 40.2 t -142.59 125.0 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.468 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -127.01 -29.28 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.575 ' HB2' HG22 ' A' ' 62' ' ' VAL . 32.7 p-90 -132.96 157.65 44.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.952 0.406 . . . . 0.0 111.727 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.62 HG13 ' HG3' ' A' ' 41' ' ' GLN . 2.3 t -139.07 150.52 23.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.255 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.43 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 73.7 m -90.99 159.97 15.87 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.492 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -145.29 93.16 2.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.208 0.528 . . . . 0.0 110.558 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -113.31 179.14 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -143.78 130.32 20.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.979 0.419 . . . . 0.0 111.427 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.8 -149.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.271 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.4 83.17 0.06 OUTLIER Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.558 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m 65.42 49.62 1.84 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.58 0.352 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.7 t -164.07 113.44 1.21 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.138 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.443 ' O ' HG13 ' A' ' 37' ' ' VAL . 31.2 mt -85.68 139.75 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 36' ' ' ILE . 4.6 m -156.57 154.5 27.04 Favored Pre-proline 0 C--O 1.233 0.185 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.28 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.729 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 44.7 Cg_endo -67.31 166.06 24.73 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.539 2.159 . . . . 0.0 112.255 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.43 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -139.1 -147.02 5.04 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.566 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.7 mp0 -31.96 133.33 0.1 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.356 0.662 . . . . 0.0 112.334 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.62 ' HG3' HG13 ' A' ' 27' ' ' VAL . 1.2 tt0 -136.37 93.97 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.12 168.61 26.02 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.098 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.468 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -86.82 -19.44 28.99 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.573 0.225 . . . . 0.0 110.799 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -89.95 112.14 23.43 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -66.72 -23.1 66.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.768 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.791 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -48.7 -35.04 13.11 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.678 0.275 . . . . 0.0 110.792 179.613 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 -38.78 90.81 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.052 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.583 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 56.9 t80 -70.97 -38.9 72.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.576 0.227 . . . . 0.0 110.926 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.791 HD12 ' HA ' ' A' ' 46' ' ' GLN . 17.0 mt -62.93 -40.28 88.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.795 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -45.9 85.21 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.359 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -31.63 67.89 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.468 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.443 ' HB3' ' CD1' ' A' ' 120' ' ' LEU . 1.8 m -74.01 83.94 1.76 Allowed 'General case' 0 C--O 1.233 0.184 0 CA-C-O 120.971 0.415 . . . . 0.0 111.182 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.2 p -100.29 -176.97 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.075 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.25 18.08 2.31 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.853 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.638 ' O ' HG13 ' A' ' 56' ' ' VAL . 47.9 t0 -144.09 79.59 1.62 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.854 0.359 . . . . 0.0 110.219 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.638 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.59 -175.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.39 -179.417 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.718 ' HD2' HG23 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -171.57 77.2 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.073 0.463 . . . . 0.0 110.671 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -132.38 170.95 14.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.463 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -106.2 174.88 5.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.583 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -151.48 157.76 42.74 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.255 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.402 ' CD2' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -135.3 121.09 19.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.799 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.575 HG22 ' HB2' ' A' ' 26' ' ' TRP . 16.2 t -135.77 127.24 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.102 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.16 118.45 26.58 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.471 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -106.3 154.14 21.18 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.863 0.364 . . . . 0.0 111.662 -179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 t -139.12 129.74 25.95 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.5 p -123.91 104.44 8.93 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.051 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.24 167.98 35.71 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.584 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -153.33 79.6 1.17 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.923 0.392 . . . . 0.0 111.167 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 37.91 44.47 0.61 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.639 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.4 ptt? -165.31 -37.4 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.494 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 p -152.39 87.44 1.32 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.437 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 18.3 mtmt -84.33 114.84 22.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.17 163.43 16.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 t -139.26 144.67 38.51 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.872 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.503 ' HE3' HD23 ' A' ' 129' ' ' LEU . 0.0 OUTLIER -143.19 150.71 39.74 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.098 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.42 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 11.6 m-85 -105.55 116.97 32.84 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.002 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.09 123.62 50.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.822 0.344 . . . . 0.0 111.428 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.442 ' HB3' ' CB ' ' A' ' 111' ' ' GLU . 3.5 tp -98.18 104.65 16.7 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.337 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.464 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 38.6 mm -85.68 100.06 8.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 86.5 m -84.8 108.77 17.64 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.31 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.661 ' CE3' HD11 ' A' ' 120' ' ' LEU . 66.5 t-105 -95.29 138.78 32.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.967 0.413 . . . . 0.0 111.435 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.508 HG23 ' OG ' ' A' ' 115' ' ' SER . 2.7 tt -141.1 88.02 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.831 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.46 123.37 33.13 Favored Glycine 0 C--N 1.336 0.563 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.57 -39.83 0.52 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -178.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.9 m-80 -73.75 42.96 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.226 0.536 . . . . 0.0 111.549 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.718 HG23 ' HD2' ' A' ' 57' ' ' ARG . 8.1 p -96.59 135.61 30.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.766 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 m -71.33 157.87 37.34 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.89 -42.83 87.11 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.987 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mt -58.85 -43.11 90.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.638 0.256 . . . . 0.0 111.045 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.92 -33.78 76.34 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.194 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -52.74 33.57 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.975 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.47 -36.44 78.97 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 179.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -43.28 69.82 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -49.19 -46.83 46.11 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.16 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.62 -45.85 93.61 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.373 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 21.8 m -62.54 -46.57 87.79 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.71 0.29 . . . . 0.0 110.877 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.573 ' HA ' HD12 ' A' ' 100' ' ' LEU . 62.8 m-20 -61.03 -37.29 82.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -57.19 -34.09 68.15 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.709 0.29 . . . . 0.0 110.637 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.7 m -72.66 -43.39 63.23 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.624 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 97' ' ' ASP . 37.9 mt -58.31 -47.13 84.66 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 38.8 t -64.64 -38.28 82.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.873 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -38.18 90.14 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.97 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -63.74 -38.93 92.96 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.758 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 t -81.59 -42.86 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.046 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -108.75 102.72 14.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.904 0.383 . . . . 0.0 110.984 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mp0 -100.93 -28.86 12.53 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.339 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -80.57 78.7 7.28 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.006 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.42 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 26.1 p90 -133.88 160.47 37.57 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.6 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -97.94 -61.89 1.32 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.437 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.87 149.54 33.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.442 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -144.93 129.46 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.673 ' HE1' HD11 ' A' ' 114' ' ' ILE . 10.4 p90 -144.02 161.78 37.89 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.97 0.414 . . . . 0.0 111.261 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.485 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 14.5 p -101.18 140.79 19.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.034 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.673 HD11 ' HE1' ' A' ' 112' ' ' PHE . 15.9 mt -133.63 148.39 30.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.508 ' OG ' HG23 ' A' ' 82' ' ' ILE . 1.7 m -131.16 26.42 4.87 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.228 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.606 ' H ' HG22 ' A' ' 114' ' ' ILE . 24.4 t70 -134.19 138.14 44.92 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.606 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -37.06 80.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.006 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -43.27 99.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -69.61 -31.56 69.75 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.613 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.661 HD11 ' CE3' ' A' ' 81' ' ' TRP . 17.1 mt -62.25 -31.96 72.59 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.969 179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -46.17 127.62 8.83 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -49.8 -41.65 45.06 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.647 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -56.2 -42.7 77.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.96 0.409 . . . . 0.0 110.278 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -64.51 -48.82 73.72 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 31.6 mt -59.26 -45.58 92.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -44.02 72.85 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.861 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.9 t -63.07 -43.16 99.37 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.744 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -52.23 65.5 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.503 HD23 ' HE3' ' A' ' 75' ' ' LYS . 2.4 mp -61.12 -31.88 71.58 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.717 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -93.77 18.5 10.18 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt -110.96 -48.89 3.07 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.618 0.247 . . . . 0.0 110.961 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -79.59 72.81 6.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.507 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 107.32 48.92 0.89 Allowed Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.435 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -161.94 50.13 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.751 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -164.43 23.41 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -174.19 32.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.713 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -69.24 -44.54 71.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.546 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -112.04 153.39 26.94 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.018 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -171.11 34.84 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.391 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -133.1 14.85 4.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.672 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.9 t -158.72 -41.33 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.512 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.13 -179.959 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.921 0.391 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m -125.06 140.12 53.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.485 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -129.39 170.13 14.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.151 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -124.48 129.38 73.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.683 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.436 ' HB2' HG12 ' A' ' 37' ' ' VAL . 4.7 m-20 -81.26 112.57 18.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.599 ' HE3' HG22 ' A' ' 104' ' ' VAL . 6.2 mptt -68.55 -40.98 80.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.753 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.52 -47.07 76.84 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.032 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.646 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -68.49 -54.15 18.73 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.266 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 m -52.86 -47.88 67.47 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.433 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -67.46 -38.62 84.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.07 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.34 -50.31 71.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.021 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.642 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.33 -45.52 93.13 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.925 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -55.66 -44.51 77.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -57.44 -42.9 83.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.911 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -39.39 93.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.944 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 13' ' ' ALA . 17.7 t -64.56 -35.15 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.129 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -38.03 63.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.048 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -71.3 114.31 9.24 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.544 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -97.58 26.44 5.0 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.407 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -108.15 -29.18 4.38 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.902 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.1 t -88.6 167.28 13.51 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.888 0.375 . . . . 0.0 111.479 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.553 ' C ' ' HB2' ' A' ' 43' ' ' ALA . . . -79.7 58.43 2.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.89 107.07 5.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.948 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 HG23 ' A' ' 62' ' ' VAL . 1.1 pp -112.69 -29.58 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.742 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.419 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.8 p-90 -127.31 160.22 32.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.998 0.427 . . . . 0.0 111.391 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.905 HG13 ' HG2' ' A' ' 41' ' ' GLN . 2.6 t -139.42 149.77 22.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.469 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 60.5 m -89.01 161.92 16.32 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.401 ' N ' HG22 ' A' ' 28' ' ' THR . 15.8 m-85 -149.0 93.45 2.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.676 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 ptmm? -132.38 142.74 49.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -85.57 133.34 34.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.058 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.24 110.14 22.23 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.184 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.87 -71.08 2.79 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.932 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.4 p -162.36 30.52 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.585 0.231 . . . . 0.0 111.204 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 37.4 p -144.33 123.95 13.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.783 0.325 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.3 mp -72.73 130.08 35.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.85 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.436 HG12 ' HB2' ' A' ' 6' ' ' ASP . 10.6 m -151.78 145.7 18.01 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.35 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.646 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 29.2 Cg_exo -62.09 168.35 9.28 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.568 2.179 . . . . 0.0 112.46 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.469 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -140.33 -145.9 4.73 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.598 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.6 mp0 -34.22 137.92 0.1 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.353 0.661 . . . . 0.0 112.582 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.905 ' HG2' HG13 ' A' ' 27' ' ' VAL . 4.9 mt-30 -134.76 96.82 3.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.002 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.13 163.13 25.1 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.437 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.553 ' HB2' ' C ' ' A' ' 23' ' ' ALA . . . -86.4 -22.37 26.62 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.719 -0.241 . . . . 0.0 110.927 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -94.8 113.38 25.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.129 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -64.36 -20.1 65.9 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.627 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.8 OUTLIER -46.46 -38.59 9.37 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.704 0.287 . . . . 0.0 110.746 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -42.01 97.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.208 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.475 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 24.3 t80 -69.07 -39.46 79.09 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.685 0.278 . . . . 0.0 110.713 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.627 HD12 ' HA ' ' A' ' 46' ' ' GLN . 25.7 mt -63.63 -34.93 70.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.067 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.29 -25.02 25.71 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.625 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -85.81 -25.41 26.33 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.596 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.6 p -75.07 66.76 1.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.892 0.377 . . . . 0.0 111.513 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -72.73 149.72 43.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.914 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.419 ' HB2' ' HB2' ' A' ' 84' ' ' GLU . 5.5 p-10 -80.56 56.06 2.5 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.453 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.699 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.0 OUTLIER -161.31 39.74 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.901 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.699 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.97 152.89 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.304 -179.564 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.476 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -112.6 129.71 56.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.407 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 pp -160.47 175.1 13.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.037 0.446 . . . . 0.0 111.782 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.494 ' CD1' HG23 ' A' ' 80' ' ' THR . 34.4 m-85 -111.3 178.83 4.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.924 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.734 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -145.6 159.88 42.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.033 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -149.02 118.66 6.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.835 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.457 HG23 HD12 ' A' ' 25' ' ' ILE . 14.4 p -149.97 139.4 15.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.791 0.329 . . . . 0.0 111.206 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.514 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 5.1 ptm180 -120.94 152.61 38.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.404 ' HD2' HD13 ' A' ' 129' ' ' LEU . 55.0 m-85 -139.19 150.8 45.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.055 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.0 t -131.97 128.24 38.02 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.651 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.6 p -117.08 93.59 4.25 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.998 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.449 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.5 172.66 36.93 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.583 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -159.88 79.53 0.7 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.123 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.25 28.79 1.07 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.577 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -146.39 -34.77 0.28 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.372 179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.22 79.78 0.68 Allowed 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.893 0.378 . . . . 0.0 110.462 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.449 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -82.04 99.42 9.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.796 -179.811 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.03 104.22 13.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.21 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.21 129.91 50.27 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmpp? -135.7 160.65 37.86 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.308 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.514 ' CD2' ' HB3' ' A' ' 63' ' ' ARG . 81.8 m-85 -112.02 163.12 14.63 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.1 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.551 ' HB2' HD12 ' A' ' 129' ' ' LEU . . . -150.92 126.58 10.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.354 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 4.6 mp -100.14 112.92 25.24 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.322 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.734 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 16.4 mt -104.11 139.6 24.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.387 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.494 HG23 ' CD1' ' A' ' 59' ' ' PHE . 15.2 m -109.23 125.86 52.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.296 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -110.11 141.79 42.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.962 0.41 . . . . 0.0 111.562 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.455 HG23 HG21 ' A' ' 86' ' ' VAL . 72.4 mt -139.59 101.88 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.888 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -75.03 90.45 0.79 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 113.832 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HB2' ' HB2' ' A' ' 54' ' ' ASP . 0.5 OUTLIER 19.09 -73.15 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 178.369 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.604 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 21.1 m-80 -41.58 -26.46 0.07 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.072 0.549 . . . . 0.0 112.183 -178.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 83' ' ' GLY . 16.6 t -44.62 104.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 m -69.16 173.52 5.53 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.01 0.433 . . . . 0.0 111.909 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.97 -45.32 93.88 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.554 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -41.68 71.25 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.854 0.359 . . . . 0.0 110.65 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.476 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.8 mp0 -65.85 -36.34 83.19 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.542 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -46.8 81.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.485 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.35 98.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.504 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -59.06 -38.6 79.76 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.59 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 28.6 m -63.89 -39.47 94.27 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.719 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -60.89 -46.21 94.99 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.331 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -40.99 98.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.601 0.239 . . . . 0.0 110.649 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' HG23 ' A' ' 101' ' ' VAL . 73.2 m-20 -65.91 -38.0 87.55 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.889 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -56.86 -33.67 67.05 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.783 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.5 m -74.83 -41.39 59.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.432 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.545 ' O ' HG23 ' A' ' 104' ' ' VAL . 25.3 mt -61.76 -46.06 91.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.016 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 97' ' ' ASP . 23.3 t -66.14 -40.87 88.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.769 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -57.2 -42.38 81.15 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -65.32 -41.13 94.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.718 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.599 HG22 ' HE3' ' A' ' 7' ' ' LYS . 38.2 t -70.44 -48.86 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.977 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -113.21 107.27 22.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.891 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -107.77 -22.44 12.47 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.853 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -75.69 79.43 2.65 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.827 0.346 . . . . 0.0 111.379 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.417 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 29.0 p90 -143.37 159.7 41.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.723 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -87.48 -58.86 2.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.162 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.6 pttp -150.18 172.63 15.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.275 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 10.3 pt-20 -153.93 150.44 28.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.226 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.509 ' HE1' HD11 ' A' ' 114' ' ' ILE . 8.8 p90 -160.18 165.99 30.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.229 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.4 p -108.39 145.34 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.251 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.568 HG22 ' H ' ' A' ' 116' ' ' ASP . 40.9 mt -135.17 146.46 30.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.692 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.7 p -138.4 29.03 2.45 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.297 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.568 ' H ' HG22 ' A' ' 114' ' ' ILE . 22.3 t70 -144.0 135.25 25.66 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.663 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -38.39 81.62 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -65.53 -46.76 78.31 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.703 0.287 . . . . 0.0 110.758 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -69.37 -30.33 68.3 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.476 ' HA ' HD23 ' A' ' 120' ' ' LEU . 0.8 OUTLIER -71.76 -23.09 61.53 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.411 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -48.22 138.44 9.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.169 0.509 . . . . 0.0 111.795 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -36.69 34.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.054 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.57 -39.76 71.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.488 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -71.25 -46.3 61.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.087 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mt -61.94 -47.9 91.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.191 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -38.33 90.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.246 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.7 t -67.54 -43.48 80.63 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.554 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -64.52 -45.13 88.56 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.106 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' A' ' 77' ' ' ALA . 0.9 OUTLIER -62.18 -34.1 75.78 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.33 179.906 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.67 -29.45 65.78 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.387 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.18 -76.85 0.46 Allowed 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.106 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 55.74 60.47 3.28 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -107.46 -49.26 0.87 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.768 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -78.05 74.56 2.0 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.809 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -172.76 26.91 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -165.5 26.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.264 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -60.51 -62.8 1.6 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.425 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -128.44 -165.74 1.54 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.073 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 66.36 26.93 10.13 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.713 0.292 . . . . 0.0 111.436 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -138.86 16.73 2.67 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 77.2 p -136.15 -49.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.719 179.795 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.848 0.356 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.78 104.25 12.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.778 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -111.24 176.87 4.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.821 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tt -134.22 128.47 52.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.027 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -81.5 94.73 6.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 1.4 mttm -60.99 -45.31 95.3 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.268 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -54.39 -44.99 72.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.094 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.522 ' HB1' HG23 ' A' ' 37' ' ' VAL . . . -73.15 -50.47 22.49 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.365 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 m -56.11 -43.69 78.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.28 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -69.68 -46.47 65.99 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.44 -43.83 62.15 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.69 0.281 . . . . 0.0 111.155 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -73.35 -36.4 66.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.605 ' CE1' HG13 ' A' ' 105' ' ' VAL . 12.5 t80 -58.82 -55.86 29.63 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.897 -179.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -67.53 -31.66 71.91 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.84 -49.77 55.59 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.654 0.264 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.716 HG21 HG11 ' A' ' 27' ' ' VAL . 44.6 t -69.0 -23.79 27.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -52.5 -36.74 55.88 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -75.64 120.1 20.58 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.285 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -91.92 40.08 1.03 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.527 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -146.84 34.65 1.33 Allowed Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.944 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.63 32.79 3.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.784 0.292 . . . . 0.0 111.528 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 55.01 29.59 12.62 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 24' ' ' VAL . 11.2 p -125.71 118.21 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.875 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -119.63 -33.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.475 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.7 p-90 -131.77 157.68 43.19 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.963 0.411 . . . . 0.0 111.041 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.716 HG11 HG21 ' A' ' 17' ' ' VAL . 17.4 m -145.83 151.99 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.52 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.533 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 40.1 m -90.5 162.06 15.22 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.709 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -146.61 91.22 2.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.173 0.511 . . . . 0.0 110.461 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.91 165.54 14.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.912 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.568 ' HB3' HD13 ' A' ' 36' ' ' ILE . 48.8 p90 -103.13 123.18 46.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.06 0.457 . . . . 0.0 111.279 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.33 114.8 24.82 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.12 38.62 59.28 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.094 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.5 p 69.28 22.39 6.67 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.708 0.403 . . . . 0.0 111.758 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.7 p -136.58 130.46 32.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 0.0 111.24 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.568 HD13 ' HB3' ' A' ' 31' ' ' TYR . 23.4 mm -68.93 130.26 33.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.983 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.522 HG23 ' HB1' ' A' ' 9' ' ' ALA . 5.4 p -150.87 138.77 12.4 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.916 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.51 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 49.3 Cg_exo -55.98 162.47 7.1 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.493 2.129 . . . . 0.0 112.579 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.533 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -133.05 -149.29 6.12 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.596 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.49 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.2 mp0 -37.08 137.51 0.34 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.322 0.649 . . . . 0.0 112.605 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' CG ' HG12 ' A' ' 27' ' ' VAL . 30.9 mt-30 -136.91 103.03 5.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.169 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.27 164.52 26.9 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.268 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -82.23 -22.64 35.76 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.675 0.274 . . . . 0.0 110.844 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -94.92 110.51 22.39 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -66.86 -19.07 65.67 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.67 -37.76 29.96 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.687 0.28 . . . . 0.0 110.674 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -36.42 83.93 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.483 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.492 ' CE1' ' HB2' ' A' ' 60' ' ' ALA . 61.4 t80 -67.47 -52.13 42.98 Favored 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.842 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.7 mt -59.09 -35.08 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.188 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.3 -47.03 74.92 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.315 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.73 -42.62 50.12 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.374 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.745 ' SG ' HD11 ' A' ' 58' ' ' LEU . 4.5 m -77.02 80.55 3.55 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 111.15 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.4 p -108.82 173.09 6.47 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.77 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.612 ' HB3' ' HB2' ' A' ' 84' ' ' GLU . 12.4 m-20 -75.2 69.05 2.02 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.029 0.442 . . . . 0.0 111.284 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.679 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.3 t70 -178.55 47.7 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.329 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.679 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -177.26 -175.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.914 -179.21 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.48 113.08 3.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.698 0.285 . . . . 0.0 111.224 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.745 HD11 ' SG ' ' A' ' 52' ' ' CYS . 3.4 pp -160.61 170.91 19.89 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.9 0.381 . . . . 0.0 111.637 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -105.65 179.36 4.29 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.722 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -160.0 172.64 17.17 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.814 0.34 . . . . 0.0 111.576 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.488 ' CE2' HG11 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -148.33 133.91 18.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.183 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.442 HG22 ' HB2' ' A' ' 26' ' ' TRP . 15.6 t -143.74 133.25 20.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.21 112.43 25.1 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.485 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -98.26 146.94 25.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.952 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.1 m -146.24 97.04 2.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.763 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.9 p -98.98 143.06 29.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.501 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.496 ' CA ' ' HA ' ' A' ' 72' ' ' LYS . . . -148.54 139.12 7.39 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.464 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -124.15 130.63 52.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.439 -0.38 . . . . 0.0 110.026 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.401 ' O ' ' HG2' ' A' ' 70' ' ' MET . . . 61.47 31.72 18.97 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.5 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER 84.84 -1.53 0.9 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.298 0.639 . . . . 0.0 112.305 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.8 m -95.24 85.91 4.41 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.788 0.327 . . . . 0.0 110.688 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.496 ' HA ' ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -96.2 148.57 22.58 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.565 -179.577 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -139.57 126.23 20.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.358 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.8 t -86.96 148.26 25.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.189 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.05 129.64 16.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.805 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.442 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 13.2 m-85 -85.5 126.7 34.04 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.595 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.21 129.33 39.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.479 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.435 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -96.44 141.84 29.25 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.218 179.556 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.629 HG23 HD12 ' A' ' 114' ' ' ILE . 27.2 mt -125.35 122.16 62.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.128 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.513 ' HB ' HG12 ' A' ' 113' ' ' VAL . 7.3 m -104.92 105.9 16.15 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.11 179.058 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -88.98 121.93 31.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.93 0.395 . . . . 0.0 111.523 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.659 HD11 HG21 ' A' ' 86' ' ' VAL . 4.2 tt -111.38 100.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.706 178.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.506 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -67.97 83.8 0.17 Allowed Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.825 -0.625 . . . . 0.0 114.109 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.612 ' HB2' ' HB3' ' A' ' 54' ' ' ASP . 2.3 mm-40 19.6 -81.34 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 178.486 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.423 ' OD1' ' HA ' ' A' ' 55' ' ' ASP . 5.6 p30 -66.51 30.83 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -177.076 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.659 HG21 HD11 ' A' ' 82' ' ' ILE . 3.0 m -64.3 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 161.46 0.5 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.92 -48.63 57.4 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.484 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.55 -33.27 72.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.696 0.284 . . . . 0.0 110.947 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -70.88 -44.78 65.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.314 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -57.69 -47.95 80.92 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.813 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.6 -39.3 93.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.892 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.13 -39.42 86.21 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.063 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -40.8 71.11 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.546 0.212 . . . . 0.0 110.656 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.14 -50.27 57.91 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.595 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -45.84 83.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.87 0.335 . . . . 0.0 110.894 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.532 ' HA ' HD12 ' A' ' 100' ' ' LEU . 74.0 m-20 -60.71 -36.95 80.09 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.262 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -59.44 -33.25 71.04 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.577 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.8 m -68.8 -44.53 73.37 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.454 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 97' ' ' ASP . 12.3 mt -61.77 -45.72 92.67 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 97' ' ' ASP . 38.7 t -65.06 -33.1 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.889 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.71 -32.59 73.99 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.19 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.77 -55.06 10.89 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.823 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.558 HG23 HG23 ' A' ' 105' ' ' VAL . 6.9 m -63.28 -33.89 63.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.614 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.605 HG13 ' CE1' ' A' ' 14' ' ' TYR . 42.1 t -108.82 101.46 12.59 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.496 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -104.3 -33.68 8.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.621 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -78.95 73.19 5.49 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.2 p90 -126.5 156.68 40.35 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.972 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.25 -49.07 4.84 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.277 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.13 141.15 6.73 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.022 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.435 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 14.1 pt-20 -135.44 149.99 49.73 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -159.9 159.84 32.85 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.707 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.513 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.7 m -89.43 153.09 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.979 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.629 HD12 HG23 ' A' ' 79' ' ' ILE . 60.8 mt -136.88 131.48 46.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.886 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -125.57 33.02 5.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.257 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.452 ' H ' HG22 ' A' ' 114' ' ' ILE . 9.7 p-10 -166.86 153.53 8.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.088 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.2 ptt85 -68.58 -24.61 64.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.872 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -63.57 -56.94 12.01 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.67 0.271 . . . . 0.0 110.849 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.467 ' HB2' HG23 ' A' ' 114' ' ' ILE . 37.7 mt-10 -72.17 -24.43 61.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.353 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.57 ' HA ' HD13 ' A' ' 114' ' ' ILE . 2.4 tp -74.33 -25.07 59.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.614 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -52.51 130.76 32.68 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.069 0.461 . . . . 0.0 111.069 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.776 ' HA ' HD12 ' A' ' 125' ' ' ILE . 41.4 tt0 -51.1 -40.6 58.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.899 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.04 -41.74 98.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.897 0.38 . . . . 0.0 110.442 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -63.2 -48.72 77.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.089 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 122' ' ' GLU . 6.9 mt -56.65 -48.07 81.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.007 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.79 -44.98 78.28 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.098 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -39.44 91.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.878 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -59.63 -53.31 59.57 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.018 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.7 pp -69.84 -24.79 63.5 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.744 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -56.54 -52.32 65.22 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 111.12 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -81.89 -38.66 24.99 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.55 48.95 19.27 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 115.69 -54.19 0.59 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.528 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 109.57 111.54 3.41 Favored Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.221 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -168.72 24.71 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -160.06 25.17 0.17 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.7 0.286 . . . . 0.0 111.329 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -59.82 -41.8 92.1 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.486 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -68.04 168.38 12.07 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.797 0.332 . . . . 0.0 110.944 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 64.04 27.59 14.22 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.595 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.47 14.34 16.64 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.898 0.38 . . . . 0.0 111.29 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 38.2 p -134.08 -54.44 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.718 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.045 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.654 0.264 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 p -117.19 123.19 46.07 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.797 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -85.25 145.97 27.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -115.76 125.55 72.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 7.6 t0 -81.97 109.36 16.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.555 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -69.1 -36.89 78.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.97 -47.83 60.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.802 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -56.67 -54.1 50.06 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.888 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.4 m -59.74 -39.0 83.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -60.1 -54.36 46.88 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.44 76.91 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.233 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.75 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -61.9 -49.12 77.48 Favored 'General case' 0 C--N 1.334 -0.072 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.19 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -55.15 -46.28 75.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.507 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 66.6 m-20 -65.49 -26.91 68.13 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.437 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 tp -80.55 -38.54 29.39 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.058 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.75 HG23 ' O ' ' A' ' 13' ' ' ALA . 8.4 t -70.33 -38.31 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.94 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 5.5 ptt180 -61.86 -28.19 69.32 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.15 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -68.86 120.83 15.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.588 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.96 27.45 3.58 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -107.84 -35.14 2.64 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.648 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.68 164.68 14.61 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.89 0.345 . . . . 0.0 111.303 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.91 58.9 3.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.0 t -133.25 119.77 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.076 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.574 HG12 ' HA ' ' A' ' 43' ' ' ALA . 30.4 pt -120.69 -40.21 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.509 ' CZ3' HG23 ' A' ' 28' ' ' THR . 37.1 p-90 -122.91 158.43 30.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.872 0.367 . . . . 0.0 111.477 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 19.4 m -140.55 143.67 28.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.935 179.145 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.509 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 3.2 p -102.28 97.29 7.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.994 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 6.0 m-85 -79.45 114.66 18.56 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.938 0.399 . . . . 0.0 110.611 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.16 162.17 34.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.695 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.427 ' HA ' ' O ' ' A' ' 35' ' ' THR . 38.7 p90 -111.04 121.61 45.79 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.039 0.447 . . . . 0.0 111.579 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.16 107.01 18.9 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.103 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.33 -78.71 1.42 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.278 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.4 m -151.65 33.97 0.55 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.601 0.239 . . . . 0.0 111.211 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.427 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 2.6 t -144.7 123.8 12.87 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 7.0 mt -84.88 126.08 40.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.158 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.493 HG12 ' CB ' ' A' ' 9' ' ' ALA . 5.9 m -148.6 156.91 41.88 Favored Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.519 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.802 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.0 Cg_endo -65.71 156.68 62.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.657 2.238 . . . . 0.0 112.295 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.41 -154.42 7.81 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.327 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.556 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.7 mp0 -27.59 132.69 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.681 0.792 . . . . 0.0 112.16 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.487 ' HG2' HG12 ' A' ' 27' ' ' VAL . 20.7 mt-30 -134.18 97.16 3.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.188 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.72 164.95 22.39 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.571 -0.823 . . . . 0.0 113.263 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.33 -17.28 24.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.743 -0.228 . . . . 0.0 111.055 179.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -92.65 129.49 38.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.673 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.506 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 23.8 t80 -77.89 -15.5 58.97 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -48.27 -41.64 28.41 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.721 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.59 -38.27 80.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.733 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.463 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 4.0 t80 -57.99 -45.78 86.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.08 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 47.7 mt -65.51 -46.18 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.995 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.97 -38.62 91.75 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.95 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 -30.93 58.79 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.73 74.57 3.39 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.808 0.337 . . . . 0.0 111.565 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -100.52 144.38 29.58 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.645 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.541 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.2 p-10 -76.05 64.96 2.0 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 111.642 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.756 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.7 t0 -168.44 44.71 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.97 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.66 -176.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.617 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.516 HH11 HG23 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -140.21 112.86 8.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.447 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.89 139.54 26.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.946 0.403 . . . . 0.0 111.466 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.479 ' CD2' HG22 ' A' ' 80' ' ' THR . 52.5 m-85 -85.69 141.53 29.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.105 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.463 ' HB1' ' CE2' ' A' ' 48' ' ' PHE . . . -160.26 113.33 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.809 0.338 . . . . 0.0 111.202 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.409 ' CB ' ' HA ' ' A' ' 78' ' ' LEU . 16.8 p90 -116.08 156.13 26.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.723 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -137.75 149.81 25.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.085 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -107.75 112.43 25.09 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.705 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -111.58 137.61 49.2 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.0 t -93.44 131.78 38.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.511 179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.3 p -134.64 116.76 15.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.624 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.521 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -148.31 142.44 10.02 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.605 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.1 79.6 1.92 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.145 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 30.91 55.97 0.22 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.426 0.631 . . . . 0.0 112.334 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.76 -46.92 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.425 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.6 m -153.9 84.61 1.15 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.935 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.521 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 2.3 ptpp? -97.67 120.08 37.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.488 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -159.56 168.07 27.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.429 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.97 139.49 37.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -118.41 141.69 48.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.608 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.602 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 0.9 OUTLIER -100.79 138.8 37.36 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.771 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.767 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -147.32 119.82 8.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.329 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 2.3 mp -92.87 118.6 31.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.546 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.92 100.02 9.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.081 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.543 ' OG1' HG22 ' A' ' 113' ' ' VAL . 0.2 OUTLIER -80.06 120.97 24.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.403 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -98.96 130.28 45.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.194 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.492 HG23 ' O ' ' A' ' 82' ' ' ILE . 2.7 tt -129.99 96.43 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.104 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.541 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -69.27 108.79 2.6 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.805 179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' C ' ' H ' ' A' ' 86' ' ' VAL . 3.7 mm-40 -34.39 -38.97 0.07 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.756 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 5.6 m-80 -73.15 43.29 0.12 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.391 0.615 . . . . 0.0 111.382 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.516 HG23 HH11 ' A' ' 57' ' ' ARG . 8.6 p -100.94 136.02 34.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.347 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 m -66.55 155.09 38.68 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.18 42.89 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.183 -0.532 . . . . 0.0 113.061 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt -56.89 -43.66 81.51 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.631 0.253 . . . . 0.0 110.922 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.59 -39.04 92.44 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.799 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -49.21 69.57 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.099 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.49 95.12 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.947 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -57.5 -41.95 81.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.7 m -59.09 -43.95 91.88 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.842 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.7 67.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.091 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.8 m -67.6 -37.9 83.22 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.565 0.221 . . . . 0.0 110.7 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.571 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 t70 -57.77 -41.95 83.08 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -30.37 68.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.278 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 m -70.79 -42.69 70.01 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.794 0.33 . . . . 0.0 110.747 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 97' ' ' ASP . 11.2 mt -62.92 -50.93 68.89 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.06 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.434 ' HA ' HG12 ' A' ' 104' ' ' VAL . 14.3 p -59.7 -30.2 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.049 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -67.35 -39.52 85.77 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.793 0.33 . . . . 0.0 110.617 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.74 -35.01 79.18 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.994 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.802 HG13 HG23 ' A' ' 105' ' ' VAL . 14.8 p -87.06 -31.5 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.634 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.802 HG23 HG13 ' A' ' 104' ' ' VAL . 40.8 t -113.38 97.71 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.846 0.355 . . . . 0.0 110.894 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -109.45 -34.32 6.56 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.689 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.75 84.1 2.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.987 0.422 . . . . 0.0 110.83 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -138.06 164.95 27.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.806 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.95 -48.05 5.03 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 1.9 ttmt -156.55 139.31 15.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.821 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 9.1 pt-20 -135.86 135.25 39.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -151.56 159.5 44.08 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.104 0.478 . . . . 0.0 111.534 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.543 HG22 ' OG1' ' A' ' 80' ' ' THR . 11.4 t -103.94 139.72 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.373 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 113' ' ' VAL . 47.5 mm -134.86 149.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.069 0.461 . . . . 0.0 111.489 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 8.6 t -119.05 -25.75 6.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.493 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.405 ' HB3' ' HB2' ' A' ' 119' ' ' GLU . 38.1 t70 -88.68 146.22 25.19 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.925 0.393 . . . . 0.0 110.895 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.748 ' HA ' HD12 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -69.37 -29.76 67.61 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.668 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.4 -32.96 43.11 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.243 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.445 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 0.5 OUTLIER -75.4 -29.28 59.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.621 -179.968 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.808 ' O ' HD22 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -95.9 -13.47 23.91 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.763 ' N ' HD13 ' A' ' 120' ' ' LEU . 0.7 OUTLIER -53.74 153.27 4.65 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 121.145 0.498 . . . . 0.0 111.592 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.691 ' HA ' HD12 ' A' ' 125' ' ' ILE . 1.8 tt0 -54.66 -37.54 65.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.895 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -42.1 93.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.84 0.353 . . . . 0.0 110.207 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.445 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 12.2 t80 -70.41 -41.8 72.49 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.0 179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 122' ' ' GLU . 23.8 mt -61.24 -57.58 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.125 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -38.2 74.47 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.415 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.9 t -70.41 -48.64 55.16 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.994 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.14 -44.88 94.29 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.653 0.263 . . . . 0.0 111.074 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.767 HD11 ' CB ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -59.89 -37.38 79.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.577 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.7 tttp -85.13 -59.06 2.44 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 111.639 0.236 . . . . 0.0 111.639 -179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -70.74 -52.88 17.99 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.421 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 58.91 34.26 23.54 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.55 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.519 ' HA3' ' CD2' ' A' ' 137' ' ' TYR . . . 57.77 41.48 93.97 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.815 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.549 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . -91.03 73.34 1.76 Allowed Glycine 0 C--N 1.336 0.576 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.516 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 80.07 19.96 0.59 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.887 0.375 . . . . 0.0 111.206 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.86 28.44 0.22 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.765 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.519 ' CD2' ' HA3' ' A' ' 133' ' ' GLY . 1.8 t80 -51.81 -62.89 1.34 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.202 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -120.1 148.65 43.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.952 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -176.1 34.18 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.155 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -114.96 12.96 16.92 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.584 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 6.1 t -153.5 -45.57 0.09 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.836 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.843 179.657 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.628 0.251 . . . . 0.0 110.517 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -138.82 151.26 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.469 HG12 HG21 ' A' ' 104' ' ' VAL . 0.6 OUTLIER -113.22 127.85 70.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.954 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -80.44 108.91 14.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.52 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.533 ' HE3' HG13 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -65.65 -37.38 86.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.209 -179.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -62.76 -54.01 45.61 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.201 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.698 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.97 -51.84 66.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.163 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 m -54.45 -43.04 71.29 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.881 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -67.73 -42.43 81.9 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.799 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.96 -51.95 64.55 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.98 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.541 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -61.54 -42.35 98.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.926 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.439 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.9 t80 -56.32 -45.22 80.43 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.844 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -57.67 -42.9 84.54 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.092 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.437 HD12 HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -63.99 -44.79 91.6 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.888 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 13' ' ' ALA . 39.2 t -62.93 -33.87 63.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -60.12 -34.79 74.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 C--O 1.233 0.229 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.567 179.418 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.211 0 CA-C-O 120.955 0.407 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.437 HG11 HD12 ' A' ' 16' ' ' LEU . 39.4 t -140.76 122.9 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.683 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -126.18 -39.41 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.836 ' HB2' HG22 ' A' ' 62' ' ' VAL . 35.9 p-90 -117.44 154.88 30.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.548 HG12 ' HG2' ' A' ' 41' ' ' GLN . 16.3 m -141.73 146.68 22.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.081 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.411 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -88.17 168.59 12.63 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.221 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.45 ' HE1' HG23 ' A' ' 27' ' ' VAL . 25.9 m-85 -148.39 100.77 3.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.283 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.48 155.13 50.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.687 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.8 p90 -106.03 133.2 51.13 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.017 0.437 . . . . 0.0 111.498 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -108.8 120.3 42.08 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.193 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.34 -74.56 1.68 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.227 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.6 37.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.779 0.323 . . . . 0.0 111.227 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.1 t -154.22 131.77 11.36 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.812 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.0 mt -78.0 138.65 19.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.604 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.1 p -153.6 140.33 12.9 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.698 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 16.6 Cg_endo -57.12 161.83 10.36 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.603 2.202 . . . . 0.0 112.292 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.403 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.64 -151.26 7.23 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.632 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.0 mp0 -34.73 140.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.619 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.548 ' HG2' HG12 ' A' ' 27' ' ' VAL . 25.8 mt-30 -137.78 97.77 3.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.357 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.79 165.64 25.83 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.598 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.06 -23.14 33.29 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.643 0.258 . . . . 0.0 110.671 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -86.47 106.97 17.85 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.824 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.432 ' HD2' HD11 ' A' ' 49' ' ' ILE . 37.7 t80 -68.76 -21.08 64.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.525 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.818 ' HA ' HD12 ' A' ' 49' ' ' ILE . 14.5 tt0 -48.04 -38.38 17.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.816 0.341 . . . . 0.0 110.675 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.67 -40.62 95.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.23 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -65.52 -43.6 89.55 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.142 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.818 HD12 ' HA ' ' A' ' 46' ' ' GLN . 6.4 mt -59.72 -42.88 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.361 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.11 -37.81 69.43 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.608 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -38.94 67.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.385 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.606 ' SG ' HD11 ' A' ' 58' ' ' LEU . 5.6 m -86.69 80.4 8.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.637 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.52 161.75 13.47 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.451 ' HA ' ' CA ' ' A' ' 83' ' ' GLY . 3.1 p-10 -72.84 69.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 111.218 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.772 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.0 OUTLIER -168.07 41.17 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.427 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.721 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.97 -172.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.587 -179.335 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.549 ' HB3' HG22 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -148.5 122.77 9.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.632 0.253 . . . . 0.0 110.525 179.026 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.606 HD11 ' SG ' ' A' ' 52' ' ' CYS . 3.0 pp -153.84 174.05 15.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.048 0.451 . . . . 0.0 111.673 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.512 ' CD2' HG21 ' A' ' 101' ' ' VAL . 5.5 m-85 -107.46 171.75 7.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.691 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.3 162.33 40.89 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.425 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.413 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.9 t80 -150.15 107.17 3.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.836 HG22 ' HB2' ' A' ' 26' ' ' TRP . 11.9 t -126.18 136.18 61.58 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.028 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -109.84 136.51 49.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.605 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -121.8 144.82 48.59 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.347 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.856 0.36 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 136.93 11.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.738 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.758 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 50.4 m-85 -84.12 152.64 24.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.427 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -151.29 116.11 5.2 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.81 110.38 22.76 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.489 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.609 HG23 HD12 ' A' ' 114' ' ' ILE . 3.6 mp -104.79 126.24 59.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.329 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.9 106.9 16.64 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.35 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.422 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 64.6 t-105 -91.88 132.95 36.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.25 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.537 HG21 HG21 ' A' ' 94' ' ' THR . 5.6 pt -138.52 84.76 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.023 0.44 . . . . 0.0 111.517 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.822 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -59.12 130.93 51.52 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.974 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 86' ' ' VAL . 12.5 mt-10 -30.35 -30.91 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.772 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -75.28 36.64 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.565 0.62 . . . . 0.0 111.719 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.822 HG23 ' O ' ' A' ' 83' ' ' GLY . 98.1 t -88.61 107.46 17.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.293 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -65.26 165.3 11.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.806 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.38 -47.47 50.71 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.918 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -42.63 99.13 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.598 0.237 . . . . 0.0 110.981 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.534 ' HB3' HG13 ' A' ' 86' ' ' VAL . 2.2 mp0 -70.67 -35.1 72.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.073 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -57.08 -53.69 55.19 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.606 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.87 73.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -61.01 -36.69 80.17 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.102 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.537 HG21 HG21 ' A' ' 82' ' ' ILE . 6.6 m -55.64 -52.3 64.29 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.44 0.162 . . . . 0.0 111.006 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.63 -43.89 98.67 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.339 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.4 m -63.35 -47.41 82.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.77 0.319 . . . . 0.0 110.642 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.58 -37.47 81.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.272 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -32.23 70.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.754 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.0 m -72.35 -41.55 66.33 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.461 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.684 ' O ' HG23 ' A' ' 104' ' ' VAL . 40.7 mt -60.13 -50.19 74.67 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.512 HG21 ' CD2' ' A' ' 59' ' ' PHE . 26.4 t -64.33 -36.81 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.0 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.17 -44.82 71.82 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -38.52 70.42 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.749 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 100' ' ' LEU . 59.6 t -58.84 -45.96 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.799 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.439 HG13 ' HE2' ' A' ' 14' ' ' TYR . 39.7 t -96.21 96.18 5.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.62 -33.18 53.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.424 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -111.13 95.97 5.86 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -126.04 178.36 5.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.111 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.758 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -121.19 -54.9 1.99 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.214 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.447 ' HB2' HD23 ' A' ' 129' ' ' LEU . 7.0 mttm -151.05 132.04 14.26 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.801 0.334 . . . . 0.0 111.452 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -136.6 125.24 23.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.508 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -152.17 161.95 41.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.009 0.433 . . . . 0.0 111.436 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 22.8 t -93.35 149.25 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.617 HD13 ' HA ' ' A' ' 120' ' ' LEU . 42.7 mt -137.19 140.58 42.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.71 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 18.1 p -128.34 23.53 5.95 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.358 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.596 ' H ' HG22 ' A' ' 114' ' ' ILE . 37.0 t70 -143.77 137.58 28.17 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.7 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.529 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 6.6 ttp180 -61.74 -37.02 82.68 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.329 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -70.74 -33.64 71.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.404 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 8.6 mt-10 -76.8 -30.61 56.5 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.078 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.617 ' HA ' HD13 ' A' ' 114' ' ' ILE . 2.6 pp -88.58 -7.41 56.49 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.207 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -54.5 152.64 6.46 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.171 0.51 . . . . 0.0 110.76 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -55.45 -42.28 74.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.27 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -31.0 72.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.697 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.427 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 11.8 t80 -75.5 -46.21 33.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.97 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.472 HD11 ' O ' ' A' ' 120' ' ' LEU . 22.9 mt -58.96 -53.58 45.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -58.59 -35.27 72.14 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.5 t -60.47 -48.0 83.69 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.655 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.53 -41.72 95.03 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.93 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 77' ' ' ALA . 18.0 mt -68.39 -43.42 77.31 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 12.7 tptm . . . . . 0 C--O 1.232 0.151 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.385 -179.616 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.415 HG21 ' HG3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.711 0.291 . . . . 0.0 110.674 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -111.87 145.13 40.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.139 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 16.2 tt -110.59 127.59 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.78 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 6.5 t0 -87.31 115.62 24.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.603 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -70.77 -45.29 65.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.287 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -59.46 -42.77 92.77 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.242 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.777 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -67.03 -56.09 11.57 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.893 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.5 t -55.47 -42.92 74.99 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.877 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -44.89 93.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.863 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.16 -46.9 69.08 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.037 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.435 ' HB1' HG11 ' A' ' 27' ' ' VAL . . . -68.15 -32.35 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.309 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.418 ' HE2' HG13 ' A' ' 105' ' ' VAL . 2.2 t80 -61.03 -56.43 21.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.649 0.261 . . . . 0.0 111.473 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -68.69 -24.55 64.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.21 -39.58 22.89 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.568 0.223 . . . . 0.0 111.53 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.93 -32.94 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.419 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -67.81 -23.97 65.24 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.203 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.8 t70 . . . . . 0 C--O 1.235 0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.636 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.491 ' C ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.961 0.41 . . . . 0.0 110.507 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.545 HG13 ' HB3' ' A' ' 41' ' ' GLN . 45.8 t -137.35 112.84 10.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.637 HD12 HG13 ' A' ' 62' ' ' VAL . 1.5 pp -125.36 -31.54 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.976 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.5 ' CZ3' HG23 ' A' ' 28' ' ' THR . 34.6 p-90 -122.91 159.49 28.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.43 . . . . 0.0 111.421 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.709 HG12 ' HG2' ' A' ' 41' ' ' GLN . 6.5 m -138.08 144.86 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.176 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.5 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 1.5 p -103.75 97.06 7.13 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.558 -179.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 10.8 m-85 -78.62 110.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 0.0 110.948 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.439 ' HE2' ' HA3' ' A' ' 39' ' ' GLY . 1.6 pttt -126.63 175.34 8.02 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.311 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -82.13 128.27 33.97 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.6 ' HB2' HG22 ' A' ' 37' ' ' VAL . 0.8 OUTLIER -96.37 69.01 2.61 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.083 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -13.77 10.13 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.284 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 169.51 -31.9 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.956 0.378 . . . . 0.0 111.104 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -91.88 177.18 6.26 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.663 0.268 . . . . 0.0 110.854 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.07 123.01 68.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.018 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 32' ' ' ASP . 28.8 m -147.26 154.65 46.1 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.192 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.777 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.1 Cg_endo -66.27 161.37 40.83 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.519 2.146 . . . . 0.0 112.174 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.439 ' HA3' ' HE2' ' A' ' 30' ' ' LYS . . . -132.7 -151.07 6.59 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.092 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.6 mp0 -27.46 133.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.32 0.648 . . . . 0.0 111.993 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.709 ' HG2' HG12 ' A' ' 27' ' ' VAL . 11.0 mt-30 -128.74 99.05 5.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.351 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.86 23.95 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.402 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.491 ' HB2' ' C ' ' A' ' 23' ' ' ALA . . . -86.74 -25.0 24.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 110.837 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.44 118.53 30.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.508 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.525 ' CD2' HG23 ' A' ' 49' ' ' ILE . 13.1 t80 -66.83 -19.6 65.77 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.646 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.02 -40.24 10.28 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.069 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -37.19 86.54 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.272 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -70.37 -49.76 45.83 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.313 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.525 HG23 ' CD2' ' A' ' 45' ' ' TYR . 20.2 pt -59.42 -23.51 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.556 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.27 -27.44 18.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.304 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.07 -33.91 33.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.747 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.4 p -66.29 81.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.037 0.446 . . . . 0.0 111.844 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -90.82 153.16 20.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -88.24 62.17 6.59 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.997 0.427 . . . . 0.0 111.299 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.743 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.1 t0 -158.85 29.94 0.22 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.231 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.743 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.87 158.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.846 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -106.44 143.7 34.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.465 179.156 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 pp -160.04 147.37 16.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.458 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -86.04 169.57 13.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.945 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 154.86 36.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.467 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -149.71 114.52 5.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.541 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.637 HG13 HD12 ' A' ' 25' ' ' ILE . 16.5 t -124.92 144.18 35.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.152 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 143.91 45.76 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.971 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -128.56 158.16 39.22 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.001 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.586 179.315 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.578 0.228 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm -119.49 162.97 17.99 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 53.0 m-85 -132.53 131.67 41.82 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.816 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.47 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -130.24 121.05 25.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.169 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.36 100.14 10.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.257 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.755 HG21 HD12 ' A' ' 114' ' ' ILE . 12.3 mt -100.91 145.38 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.162 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.932 ' HB ' HG12 ' A' ' 113' ' ' VAL . 16.1 m -117.18 120.73 39.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.231 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.525 ' CE3' HD11 ' A' ' 120' ' ' LEU . 72.6 t-105 -92.09 143.81 26.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.329 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.534 HG23 HG11 ' A' ' 86' ' ' VAL . 56.8 mt -139.56 111.1 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.129 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -89.44 107.4 3.4 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 113.376 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 7.56 -68.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 178.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.568 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 9.5 m-80 -42.38 -26.25 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.943 0.497 . . . . 0.0 111.925 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.798 HG13 ' HB3' ' A' ' 90' ' ' GLN . 74.3 t -54.06 100.19 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.291 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.7 p -75.33 -178.41 3.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.57 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.44 -47.72 62.06 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.184 -0.531 . . . . 0.0 112.639 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.1 mt -59.02 -46.59 87.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.714 0.293 . . . . 0.0 110.621 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.798 ' HB3' HG13 ' A' ' 86' ' ' VAL . 5.8 mp0 -65.59 -38.56 89.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.521 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -63.49 -39.61 94.89 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 -34.27 77.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.071 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.415 ' HG3' HG21 ' A' ' 3' ' ' THR . 0.1 OUTLIER -59.69 -46.27 89.59 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -34.51 73.33 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.76 -51.68 54.0 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.966 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 m -64.34 -37.56 87.94 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.711 0.291 . . . . 0.0 110.665 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.732 ' HA ' HD12 ' A' ' 100' ' ' LEU . 9.1 m-20 -60.56 -40.93 93.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.69 -32.11 68.84 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.574 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.8 m -69.42 -44.13 71.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.771 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.732 HD12 ' HA ' ' A' ' 97' ' ' ASP . 7.5 mt -62.07 -46.64 88.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.855 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 97' ' ' ASP . 21.7 t -67.17 -33.36 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.165 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 ttpp -70.13 -38.39 75.53 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.955 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -30.67 69.22 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.904 HG13 HG23 ' A' ' 105' ' ' VAL . 13.9 p -92.7 -32.03 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.233 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.904 HG23 HG13 ' A' ' 104' ' ' VAL . 26.0 t -122.02 109.41 24.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.925 0.393 . . . . 0.0 110.867 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -18.53 13.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.762 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.04 79.66 2.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.764 0.316 . . . . 0.0 111.024 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.428 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.0 p90 -140.73 159.9 41.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.59 -55.17 2.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.45 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.7 150.05 51.52 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.777 0.322 . . . . 0.0 111.274 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.22 124.62 15.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.078 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.689 ' HE2' HD11 ' A' ' 114' ' ' ILE . 33.2 p90 -160.31 153.44 21.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.897 0.38 . . . . 0.0 111.366 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.932 HG12 ' HB ' ' A' ' 80' ' ' THR . 6.2 m -90.99 153.8 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.975 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.755 HD12 HG21 ' A' ' 79' ' ' ILE . 60.1 mt -139.56 142.18 33.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.928 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.21 25.87 3.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.383 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.539 ' H ' HG22 ' A' ' 114' ' ' ILE . 13.9 t70 -139.14 139.39 37.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.888 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -67.21 -36.78 82.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.999 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -66.2 -45.37 81.01 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.548 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 -25.12 64.8 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.049 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.525 HD11 ' CE3' ' A' ' 81' ' ' TRP . 5.9 mt -73.56 -31.37 63.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.981 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -49.45 136.63 16.07 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.008 0.433 . . . . 0.0 111.385 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -31.08 7.28 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.143 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -59.74 -41.84 91.83 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 120.932 0.396 . . . . 0.0 110.261 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -76.78 -43.46 36.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.111 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.619 HG22 HD13 ' A' ' 129' ' ' LEU . 38.2 mm -60.53 -47.33 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.255 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -62.56 -32.84 73.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.3 t -68.91 -47.58 65.42 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.604 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -66.16 -39.94 90.17 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.135 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.619 HD13 HG22 ' A' ' 125' ' ' ILE . 0.6 OUTLIER -61.57 -23.46 65.99 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.663 -179.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.1 tptm . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.612 0.244 . . . . 0.0 111.26 179.653 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.677 0.275 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -112.6 147.37 36.82 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.02 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.472 HD12 HG21 ' A' ' 36' ' ' ILE . 2.3 tt -109.42 126.98 66.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.52 107.96 13.76 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.509 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 2.2 mttt -63.03 -38.57 91.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.289 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.6 -52.44 65.41 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.143 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.746 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.14 -50.88 68.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.3 m -54.52 -43.43 71.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.117 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -61.35 -45.3 94.98 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.681 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.65 73.62 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.656 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.54 -52.01 67.01 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.963 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.43 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.9 t80 -56.23 -45.91 79.75 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.89 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -57.23 -46.22 83.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -43.35 83.99 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.062 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.656 HG23 ' O ' ' A' ' 13' ' ' ALA . 55.1 t -65.84 -33.55 64.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.984 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -59.19 -38.91 81.01 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 C--O 1.233 0.206 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.309 179.363 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.338 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.643 HG11 ' HB3' ' A' ' 41' ' ' GLN . 48.8 t -133.85 125.74 49.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-O 120.579 0.228 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.444 HD11 ' HD1' ' A' ' 26' ' ' TRP . 1.2 pp -113.07 -31.0 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.823 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.639 ' HB2' HG22 ' A' ' 62' ' ' VAL . 37.0 p-90 -127.86 157.66 39.88 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 110.968 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.699 HG12 ' HG2' ' A' ' 41' ' ' GLN . 10.2 m -140.46 144.78 26.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.723 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.421 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 98.0 m -88.28 161.42 17.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.696 0.284 . . . . 0.0 110.908 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -144.64 97.17 2.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.99 0.424 . . . . 0.0 110.518 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.86 -178.63 4.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.97 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.596 ' HB3' HD13 ' A' ' 36' ' ' ILE . 39.4 p90 -112.97 118.27 34.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.001 0.429 . . . . 0.0 111.275 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.75 111.45 23.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.192 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.7 -75.41 1.84 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.237 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.27 35.41 0.17 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 111.069 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 t -155.68 140.73 17.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.596 HD13 ' HB3' ' A' ' 31' ' ' TYR . 33.5 mm -70.61 137.35 24.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.811 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.606 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.6 p -160.27 139.87 8.2 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.996 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.746 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 12.9 Cg_endo -55.28 152.7 30.53 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.822 2.348 . . . . 0.0 112.16 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.421 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -124.62 -150.35 7.83 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.746 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 17.6 mp0 -32.05 136.25 0.07 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.651 0.781 . . . . 0.0 112.727 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.699 ' HG2' HG12 ' A' ' 27' ' ' VAL . 20.0 mt-30 -136.85 97.49 3.54 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.328 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.22 168.94 25.58 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.773 -0.727 . . . . 0.0 113.461 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.77 -20.07 23.97 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.708 0.289 . . . . 0.0 110.618 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -93.24 128.62 39.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.541 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -76.83 -21.29 55.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.787 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -38.55 19.92 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.962 0.41 . . . . 0.0 110.489 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -37.5 87.44 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.401 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.483 ' HE2' HD22 ' A' ' 120' ' ' LEU . 46.1 t80 -69.33 -48.78 60.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.22 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 52.0 mt -62.1 -38.98 82.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.357 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.99 -41.07 87.38 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.673 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -34.01 46.41 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.69 84.95 3.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.9 p -85.85 169.62 13.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.188 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -83.79 17.87 2.17 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.777 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -134.27 65.08 1.58 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.787 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 170.25 143.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.625 -179.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.593 ' HB3' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -112.79 125.84 54.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.631 178.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 pp -153.81 171.93 18.14 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.019 0.437 . . . . 0.0 111.503 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -104.9 167.16 9.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.54 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -153.8 155.32 35.61 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.641 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.494 ' CE1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -145.55 119.16 9.13 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.639 HG22 ' HB2' ' A' ' 26' ' ' TRP . 22.1 t -128.35 144.37 38.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.951 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 mmt85 -100.44 105.33 16.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.613 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -90.17 153.63 20.37 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.273 179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.234 0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.434 ' HE2' HD23 ' A' ' 129' ' ' LEU . 9.3 mtpt -143.17 149.89 38.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.02 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -106.39 118.83 37.66 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.417 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -129.53 119.23 23.35 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.251 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.51 ' HG ' ' HB3' ' A' ' 111' ' ' GLU . 0.5 OUTLIER -99.34 124.61 44.59 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.09 179.444 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.565 HG21 ' CD1' ' A' ' 114' ' ' ILE . 1.1 mt -116.43 145.58 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.687 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -112.5 114.34 26.97 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.288 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.411 ' CD2' HD11 ' A' ' 120' ' ' LEU . 48.1 t-105 -91.99 135.67 33.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.533 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mt -138.2 89.91 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.151 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.685 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -61.09 116.83 9.92 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.975 -0.631 . . . . 0.0 111.664 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.8 mt-10 -29.21 -40.31 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.4 m-80 -72.27 41.55 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.115 0.483 . . . . 0.0 111.985 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.685 HG23 ' O ' ' A' ' 83' ' ' GLY . 20.1 t -107.71 122.76 62.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.11 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -72.4 164.45 26.33 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.85 0.357 . . . . 0.0 111.39 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.17 -44.32 57.2 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.022 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.33 -47.88 77.85 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.638 0.256 . . . . 0.0 110.896 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.453 ' CB ' HG13 ' A' ' 86' ' ' VAL . 0.7 OUTLIER -68.21 -34.97 77.24 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.49 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -60.51 -45.18 94.73 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.89 87.59 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.776 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -53.25 -40.72 64.81 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.857 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 m -56.49 -41.92 77.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.173 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.95 -45.02 97.0 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.624 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -46.35 55.16 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.514 0.197 . . . . 0.0 111.251 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.809 ' HA ' HD12 ' A' ' 100' ' ' LEU . 34.0 m-20 -64.11 -35.06 79.52 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.448 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -55.85 -36.66 67.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.877 0.37 . . . . 0.0 110.259 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.5 m -72.95 -42.15 63.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.279 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.809 HD12 ' HA ' ' A' ' 97' ' ' ASP . 9.7 mt -59.78 -48.88 79.89 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.99 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 97' ' ' ASP . 46.9 t -62.38 -46.29 96.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -36.9 76.64 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.947 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.38 -35.83 81.7 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.089 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 100' ' ' LEU . 40.4 t -76.77 -42.92 33.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.43 HG13 ' HE2' ' A' ' 14' ' ' TYR . 36.9 t -119.97 108.56 23.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.032 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.73 -25.38 12.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.586 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -78.89 85.35 4.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.834 0.35 . . . . 0.0 110.782 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -133.24 177.41 7.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.002 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.91 -57.6 2.09 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.501 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.413 ' HE3' ' HG3' ' A' ' 128' ' ' GLU . 35.2 tttm -135.88 140.35 44.05 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.219 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.51 ' HB3' ' HG ' ' A' ' 78' ' ' LEU . 9.1 pt-20 -141.28 132.36 26.26 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.873 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.583 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 11.8 p90 -154.24 168.23 27.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.968 0.413 . . . . 0.0 111.63 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 23.0 t -106.9 145.29 14.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.028 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.593 HG23 ' HB2' ' A' ' 119' ' ' GLU . 84.5 mt -124.65 134.28 67.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.594 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -122.2 17.96 10.72 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.723 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.449 ' H ' HG22 ' A' ' 114' ' ' ILE . 6.8 p-10 -155.3 145.5 21.8 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 111.022 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -61.05 -28.68 69.24 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.497 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -59.93 -46.77 88.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.612 0.244 . . . . 0.0 110.561 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.593 ' HB2' HG23 ' A' ' 114' ' ' ILE . 5.7 mt-10 -66.63 -41.83 87.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.456 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.483 HD22 ' HE2' ' A' ' 48' ' ' PHE . 12.3 mt -53.36 -35.44 60.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.586 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -42.83 126.56 3.8 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.567 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.77 -37.89 44.88 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.007 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -59.24 -46.4 88.58 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.803 0.335 . . . . 0.0 110.619 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -61.41 -50.45 72.81 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.906 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.583 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 32.6 mm -56.93 -45.76 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -48.32 74.53 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.348 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -62.87 -42.43 99.75 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.857 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.413 ' HG3' ' HE3' ' A' ' 110' ' ' LYS . 2.0 tp10 -58.0 -50.91 71.8 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.018 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -65.25 -37.74 88.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.687 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.666 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.9 p . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.554 0.216 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -119.57 149.11 42.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.097 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.567 ' HB ' HD12 ' A' ' 36' ' ' ILE . 17.1 tt -132.5 131.0 60.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.84 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.07 105.59 13.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.878 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -60.27 -41.47 93.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -62.42 -43.6 98.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.757 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -64.88 -57.34 9.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.091 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 t -54.33 -43.58 71.34 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.871 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.95 -45.18 94.81 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.713 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.68 -50.36 68.42 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 -50.78 72.68 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.627 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -55.94 -43.14 77.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.037 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.469 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 68.0 m-20 -64.55 -33.79 76.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.793 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -70.63 -46.81 62.63 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.701 0.286 . . . . 0.0 111.15 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 t -68.34 -38.69 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.449 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 9.6 ptm180 -67.52 -23.9 65.5 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.939 0.399 . . . . 0.0 111.291 -179.777 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.306 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.592 HG11 ' HB3' ' A' ' 41' ' ' GLN . 67.7 t -143.22 117.8 4.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.493 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -108.11 -29.4 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.444 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.638 ' CB ' HG22 ' A' ' 62' ' ' VAL . 42.5 p-90 -129.78 159.62 35.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.966 0.412 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -144.89 150.51 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.908 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.473 HG23 ' HE1' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -91.06 162.57 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.027 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -148.18 101.6 3.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 pttt -132.23 159.71 38.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 35' ' ' THR . 54.3 p90 -116.01 131.79 56.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.74 103.04 14.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.849 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.84 -73.27 2.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.758 . . . . 0.0 111.734 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -155.45 32.81 0.37 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.724 0.297 . . . . 0.0 111.464 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 0.7 OUTLIER -140.5 117.56 11.19 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.567 HD12 ' HB ' ' A' ' 5' ' ' ILE . 11.2 mt -77.35 133.45 30.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.245 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.546 HG23 ' HB1' ' A' ' 9' ' ' ALA . 11.3 p -151.2 137.72 11.48 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.757 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 19.5 Cg_endo -58.33 158.12 23.77 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.567 2.178 . . . . 0.0 112.639 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.441 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -127.12 -152.17 7.92 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.629 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 10.0 mp0 -35.48 140.81 0.09 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.536 0.734 . . . . 0.0 112.515 -179.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.592 ' HB3' HG11 ' A' ' 24' ' ' VAL . 30.1 mt-30 -139.03 98.2 3.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.518 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.56 167.56 24.74 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.26 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.493 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -85.41 -20.14 30.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.696 -0.252 . . . . 0.0 110.972 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -93.05 107.58 19.34 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.457 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.94 -21.17 65.11 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -46.34 -39.7 10.67 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.776 0.322 . . . . 0.0 110.631 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -42.55 94.94 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.409 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.705 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 40.0 t80 -68.12 -42.41 80.25 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.878 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.01 -35.13 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.207 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.36 -37.25 25.91 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.694 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.98 -42.55 57.37 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -72.66 84.17 1.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.111 0.481 . . . . 0.0 111.049 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.05 164.48 22.44 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.563 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.4 38.5 0.83 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.777 0.323 . . . . 0.0 111.793 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.757 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -139.47 45.28 1.95 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.922 0.391 . . . . 0.0 111.336 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.48 157.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.812 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.31 134.91 45.91 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.325 179.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.9 mt -147.22 170.42 17.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.063 0.459 . . . . 0.0 111.965 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -119.68 160.5 22.41 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.118 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.705 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -155.81 153.44 29.79 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.897 0.379 . . . . 0.0 111.63 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -139.38 122.62 16.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.578 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.638 HG22 ' CB ' ' A' ' 26' ' ' TRP . 11.5 t -130.53 142.38 43.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.91 0.386 . . . . 0.0 111.628 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -101.92 118.47 36.99 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.717 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -102.15 165.1 11.33 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.98 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.233 0.229 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.603 179.754 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.876 0.37 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -144.18 162.71 35.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.602 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 8.2 m-85 -106.35 153.85 21.62 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.795 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.626 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -154.65 125.94 7.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.633 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.3 tt -92.66 127.33 38.12 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.345 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.428 HD13 HD13 ' A' ' 125' ' ' ILE . 29.5 mt -122.02 107.94 20.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.603 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.413 ' HB ' HG22 ' A' ' 113' ' ' VAL . 7.2 m -97.33 132.01 43.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.007 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -114.13 141.84 46.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.871 0.367 . . . . 0.0 111.304 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.6 mt -137.27 104.11 3.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.42 124.12 6.37 Favored Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.372 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -27.61 -51.38 0.07 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.722 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 12.9 m-80 -71.41 49.07 0.15 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -178.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.444 HG13 ' O ' ' A' ' 86' ' ' VAL . 7.1 p -112.39 115.4 49.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.389 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.62 160.06 28.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.051 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.83 -44.45 61.09 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.708 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.25 -45.29 88.08 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.79 0.328 . . . . 0.0 110.795 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.45 -44.1 79.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.686 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -59.09 -46.22 88.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.637 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.04 88.37 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.937 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.83 -44.09 81.71 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.764 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.429 ' O ' ' HB2' ' A' ' 98' ' ' LYS . 9.5 m -50.18 -40.05 45.73 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.662 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.83 -46.85 80.16 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.793 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.97 -44.93 79.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.065 0.433 . . . . 0.0 111.114 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -62.33 -36.25 81.59 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.875 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -58.06 -34.48 70.16 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.9 m -71.0 -43.29 68.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.705 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 83.4 mt -59.57 -50.75 72.69 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.128 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.14 -31.66 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.954 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.9 -32.61 72.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.105 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -48.67 62.97 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.457 HG23 HG23 ' A' ' 105' ' ' VAL . 6.7 m -71.19 -28.67 33.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.457 HG23 HG23 ' A' ' 104' ' ' VAL . 56.1 t -101.22 102.05 12.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -99.48 -32.03 11.33 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.456 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -85.9 86.12 7.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.818 0.342 . . . . 0.0 111.343 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.468 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 p90 -140.25 158.01 44.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.702 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -100.83 -59.6 1.67 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.492 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 151.57 47.49 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.283 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -139.69 135.83 33.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.998 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -160.14 165.62 31.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.03 0.443 . . . . 0.0 111.271 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.413 HG22 ' HB ' ' A' ' 80' ' ' THR . 20.2 t -111.24 139.03 37.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.521 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.548 HG22 ' H ' ' A' ' 116' ' ' ASP . 49.2 mt -124.3 142.41 41.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.9 p -135.12 26.5 3.54 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.362 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.548 ' H ' HG22 ' A' ' 114' ' ' ILE . 34.6 t70 -138.09 138.05 38.34 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.417 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -60.5 -35.15 75.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.684 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.66 -46.9 71.08 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.535 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 1.7 mp0 -69.39 -28.95 66.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.843 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.461 ' O ' HD11 ' A' ' 125' ' ' ILE . 0.4 OUTLIER -67.01 -30.61 70.76 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.728 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -52.17 132.12 33.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.684 ' HA ' HD12 ' A' ' 125' ' ' ILE . 2.7 tp10 -52.44 -35.07 51.34 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.991 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -61.67 -38.93 89.59 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.868 0.366 . . . . 0.0 110.607 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.535 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 7.9 t80 -68.82 -51.58 39.22 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.684 HD12 ' HA ' ' A' ' 122' ' ' GLU . 5.1 mt -54.68 -40.67 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.964 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -51.26 -41.9 60.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.006 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.7 t -70.88 -42.52 69.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -56.02 -34.65 66.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.711 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.626 HD11 ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -64.99 -50.27 66.99 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.556 0.217 . . . . 0.0 111.408 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 tttm . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.283 -179.751 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.8 0.333 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -106.81 164.74 11.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.156 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.643 ' HB ' HD12 ' A' ' 36' ' ' ILE . 5.2 tt -115.26 130.38 69.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.021 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.62 101.98 8.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.472 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.36 -41.07 92.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.909 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -59.67 -51.63 68.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.948 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.621 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.12 -52.83 63.22 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.951 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.46 -39.39 73.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.153 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -44.94 96.32 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.99 67.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.25 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.474 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.41 -48.21 73.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.264 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.542 ' HE2' HG22 ' A' ' 105' ' ' VAL . 0.7 OUTLIER -56.18 -46.97 79.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.886 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -55.89 -40.84 73.58 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.468 HD21 HG21 ' A' ' 24' ' ' VAL . 15.9 tp -65.46 -44.52 86.92 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.972 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 13' ' ' ALA . 27.6 t -65.89 -35.01 74.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.779 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -61.17 -33.54 73.6 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 C--O 1.233 0.217 0 CA-C-O 121.034 0.445 . . . . 0.0 111.054 179.867 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.671 HG11 ' HB3' ' A' ' 41' ' ' GLN . 58.2 t -144.99 125.37 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-O 120.732 0.301 . . . . 0.0 110.906 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.508 HD12 HG23 ' A' ' 62' ' ' VAL . 1.3 pp -112.46 -28.57 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.749 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -131.24 155.61 46.81 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.581 HG22 ' HB3' ' A' ' 61' ' ' PHE . 34.7 m -140.85 149.51 20.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.005 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.63 175.89 6.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.85 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -151.13 93.59 1.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.404 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -102.87 176.0 5.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -89.67 144.11 26.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.111 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.511 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.5 OUTLIER -122.77 79.09 1.6 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.888 178.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -72.58 2.13 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.468 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.4 m -150.13 31.89 0.68 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.806 0.336 . . . . 0.0 110.766 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.0 p -146.39 176.97 9.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.033 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.643 HD12 ' HB ' ' A' ' 5' ' ' ILE . 10.9 mt -106.85 131.39 56.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.182 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.511 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 23.2 m -145.73 138.45 13.89 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.926 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.621 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 32.1 Cg_exo -58.21 168.22 3.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.468 2.112 . . . . 0.0 112.804 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.73 -153.78 7.15 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.993 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.425 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.4 mp0 -35.47 141.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.286 0.634 . . . . 0.0 112.428 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.671 ' HB3' HG11 ' A' ' 24' ' ' VAL . 15.9 mt-30 -136.84 98.12 3.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.356 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.42 168.62 25.76 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.839 -0.695 . . . . 0.0 113.209 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.415 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.88 -19.35 27.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.634 0.254 . . . . 0.0 110.86 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -89.97 111.27 22.29 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.7 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -68.0 -24.53 65.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.603 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.542 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -48.63 -36.09 15.07 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.016 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.25 -35.31 79.92 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.264 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.541 ' HE2' HD11 ' A' ' 120' ' ' LEU . 80.1 t80 -68.03 -40.6 82.86 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.561 0.22 . . . . 0.0 111.04 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.542 HD12 ' HA ' ' A' ' 46' ' ' GLN . 18.1 mt -64.31 -44.69 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.167 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -64.64 -40.8 96.09 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.768 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.39 -29.2 59.75 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.5 83.94 3.9 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.962 0.41 . . . . 0.0 111.35 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.61 173.59 8.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.577 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.2 2.8 17.03 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.686 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -126.41 77.37 1.69 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.751 0.31 . . . . 0.0 110.586 -179.659 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.684 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -170.11 -175.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.372 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.419 ' HD3' ' HG2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -169.39 74.36 0.09 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.2 pp -129.39 168.12 16.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.338 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -96.38 170.54 9.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.87 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.418 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -142.0 145.21 34.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.972 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.581 ' HB3' HG22 ' A' ' 27' ' ' VAL . 1.1 t80 -132.77 128.55 37.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 9.8 p -150.38 134.31 8.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.841 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 ttp-105 -103.91 132.38 50.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -104.3 161.65 13.88 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.919 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 65' ' ' THR . 8.9 t . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.724 179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.627 0.251 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mtmt -137.56 144.31 41.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.435 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.504 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 6.4 m-85 -90.03 153.54 20.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.034 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 62' ' ' VAL . . . -140.31 114.88 9.41 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.243 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.497 HD11 HG12 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -103.33 93.22 4.86 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.638 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.641 HD13 HD13 ' A' ' 125' ' ' ILE . 5.4 mt -96.53 155.61 3.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.879 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.566 ' HB ' HG23 ' A' ' 113' ' ' VAL . 7.1 m -133.72 132.0 40.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.668 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.522 ' CE3' HD22 ' A' ' 120' ' ' LEU . 55.1 t-105 -108.71 129.38 55.36 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.853 0.359 . . . . 0.0 110.97 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.485 ' O ' HG23 ' A' ' 82' ' ' ILE . 2.9 tt -125.73 100.87 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.718 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.413 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -75.37 113.91 4.1 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.086 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.6 mm-40 -24.56 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.686 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.3 m-80 -71.26 44.27 0.09 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.105 0.479 . . . . 0.0 111.67 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 84' ' ' GLU . 9.0 t -77.47 142.58 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.471 179.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 162.05 29.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.029 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.17 -61.92 6.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.975 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -34.55 76.2 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.491 0.186 . . . . 0.0 111.217 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.419 ' HG2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -57.94 -33.36 68.74 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.29 179.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -52.91 -38.38 61.73 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.983 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.3 -37.09 23.9 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.101 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -57.59 -43.32 84.55 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.298 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.6 p -59.26 -37.6 78.02 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.267 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.92 -50.43 60.95 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.613 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.9 t -67.64 -31.54 71.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.624 0.249 . . . . 0.0 111.018 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.62 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.73 -39.17 83.79 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.243 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -57.0 -33.42 67.12 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.786 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.9 m -72.48 -44.33 62.45 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 97' ' ' ASP . 17.5 mt -59.56 -45.31 92.22 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.991 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 78' ' ' LEU . 46.1 t -65.78 -40.04 86.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 -36.6 80.68 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -45.76 78.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.739 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 29.6 t -71.87 -45.65 63.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.542 HG22 ' HE2' ' A' ' 14' ' ' TYR . 21.3 t -106.04 101.57 12.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.869 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -107.57 -32.24 7.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.443 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -81.44 71.82 8.45 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.903 0.382 . . . . 0.0 110.669 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.475 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 19.9 p90 -124.16 162.26 23.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.068 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.29 -46.52 5.78 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.66 132.0 15.58 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.067 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -133.43 127.87 34.3 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.417 ' HE2' HD11 ' A' ' 114' ' ' ILE . 14.2 p90 -160.35 162.45 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.981 0.42 . . . . 0.0 111.604 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.566 HG23 ' HB ' ' A' ' 80' ' ' THR . 11.2 p -109.07 143.02 20.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.534 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.657 HD13 ' HA ' ' A' ' 120' ' ' LEU . 4.4 mt -128.13 136.99 58.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.9 m -100.96 -31.52 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.063 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -88.6 139.09 30.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.947 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 mmm-85 -70.5 -36.45 73.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.167 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -47.86 77.57 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.674 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -70.07 -23.85 63.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.008 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.657 ' HA ' HD13 ' A' ' 114' ' ' ILE . 6.7 tp -81.61 -21.64 38.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.8 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -47.88 138.78 8.41 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.094 0.473 . . . . 0.0 111.567 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -35.44 21.52 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.049 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -38.84 75.59 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.983 0.42 . . . . 0.0 110.175 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -77.85 -42.04 34.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.641 HD13 HD13 ' A' ' 79' ' ' ILE . 49.8 mt -58.75 -50.09 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.029 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -54.8 -39.32 68.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.2 t -72.4 -44.37 62.57 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -58.12 -48.1 81.26 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.976 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.481 ' CD1' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -61.02 -31.5 71.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.101 179.665 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.957 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 120.643 0.259 . . . . 0.0 110.677 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -135.69 -179.9 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.006 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 tt -146.29 133.13 14.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.886 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.592 ' HB3' HG12 ' A' ' 37' ' ' VAL . 6.8 t70 -77.27 112.74 14.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.744 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.44 -45.28 76.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.058 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.81 -50.17 74.84 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.671 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -60.0 -57.0 14.74 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.305 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.628 ' HB3' HG11 ' A' ' 104' ' ' VAL . 34.2 m -58.49 -46.66 86.24 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.407 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -60.42 -49.66 76.68 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.42 -47.65 69.41 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.903 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.452 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -58.81 -35.03 72.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.452 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -66.09 -62.1 1.67 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.31 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -64.08 -32.8 74.5 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.919 0.341 . . . . 0.0 111.919 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.5 tt -61.55 -49.66 75.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.749 0.309 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.489 HG21 HG21 ' A' ' 27' ' ' VAL . 46.7 t -75.4 -32.03 24.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -4.35 41.5 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.896 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.234 0.247 0 CA-C-O 120.813 0.34 . . . . 0.0 111.14 -179.797 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.576 HG11 ' HB3' ' A' ' 41' ' ' GLN . 49.4 t -152.92 101.77 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.281 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.486 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -85.81 -27.35 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.644 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.471 ' HD1' HD11 ' A' ' 25' ' ' ILE . 21.9 p-90 -138.46 153.85 48.84 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.344 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.778 HG13 ' HG2' ' A' ' 41' ' ' GLN . 3.4 t -139.45 152.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.992 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.582 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 1.7 m -92.15 165.85 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.757 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -149.69 99.45 2.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.225 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 153.09 52.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.855 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 36' ' ' ILE . 55.1 p90 -96.07 128.77 43.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.414 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.19 109.02 21.85 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.842 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.62 -50.66 3.87 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.195 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.6 p -171.14 -33.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -83.5 132.62 34.93 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.876 0.37 . . . . 0.0 111.41 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.476 ' HA ' ' HA ' ' A' ' 31' ' ' TYR . 50.7 mt -79.5 136.07 24.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.954 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.592 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.6 m -151.03 155.94 35.19 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.671 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 43.3 Cg_endo -67.86 164.72 30.51 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.318 2.012 . . . . 0.0 112.09 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.582 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -134.38 -150.76 6.23 Favored Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.554 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.6 mp0 -31.59 136.13 0.06 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.461 0.705 . . . . 0.0 112.579 -179.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.778 ' HG2' HG13 ' A' ' 27' ' ' VAL . 8.2 mt-30 -130.69 91.37 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.228 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.66 164.18 25.18 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.26 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.486 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -88.35 -23.46 23.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.686 0.279 . . . . 0.0 110.718 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.96 115.51 22.85 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.688 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.427 ' HD2' HD11 ' A' ' 49' ' ' ILE . 30.3 t80 -67.22 -22.46 65.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.93 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -48.07 -37.2 14.59 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.663 179.512 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -38.67 91.87 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.298 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 47.0 t80 -67.91 -41.73 82.23 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.633 0.254 . . . . 0.0 111.013 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 46' ' ' GLN . 21.8 mt -63.51 -42.49 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.64 -40.5 73.05 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.642 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -34.29 68.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.623 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.5 m -76.44 82.98 3.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.961 0.41 . . . . 0.0 111.431 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.49 162.18 24.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -84.83 13.27 6.04 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.777 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -129.2 52.71 1.94 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 110.721 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 171.69 148.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.847 -179.492 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.537 ' HB3' HG23 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -111.3 129.13 56.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.73 179.554 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.43 174.47 10.6 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -115.79 167.2 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.264 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -151.82 154.01 35.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 111.415 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.506 ' CE1' HG11 ' A' ' 105' ' ' VAL . 1.7 t80 -136.21 110.07 8.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.12 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 t -115.29 122.68 69.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.723 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.41 107.72 18.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.84 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -103.59 159.17 15.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.052 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.8 t . . . . . 0 C--N 1.332 -0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.685 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.84 0.352 . . . . 0.0 111.019 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HD3' ' HG ' ' A' ' 129' ' ' LEU . 20.6 mttm -130.87 121.99 26.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.961 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -96.08 117.6 31.03 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.426 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.721 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -119.07 138.39 52.91 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.488 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 11.5 tp -117.7 100.18 7.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.559 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 39.0 mt -85.95 113.66 24.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.077 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.439 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 4.5 m -99.53 108.69 21.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.528 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -98.52 141.12 31.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.885 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.537 HG23 ' HB3' ' A' ' 57' ' ' ARG . 46.2 mt -139.9 94.1 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.261 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.693 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -62.84 109.77 2.9 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.518 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.3 mm-40 -33.78 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.662 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.6 m-80 -73.13 41.81 0.11 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.273 0.558 . . . . 0.0 111.575 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.693 HG13 ' O ' ' A' ' 83' ' ' GLY . 2.5 m -99.26 137.33 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.348 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 m -66.28 165.55 13.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.772 0.32 . . . . 0.0 111.23 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.08 -36.47 67.89 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.98 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.81 -36.12 82.86 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.553 0.216 . . . . 0.0 111.083 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -36.77 84.55 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.042 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.94 -45.27 78.84 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.782 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -35.71 74.19 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.197 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.11 -41.82 68.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.475 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -58.04 -39.26 77.99 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.136 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.23 -49.21 67.64 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.379 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -42.94 88.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.586 0.231 . . . . 0.0 110.964 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.559 ' O ' HG23 ' A' ' 101' ' ' VAL . 0.8 OUTLIER -60.39 -36.11 77.34 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.179 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -34.53 65.75 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.907 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 59.1 m -76.45 -47.79 21.85 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.903 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.401 ' O ' HG23 ' A' ' 104' ' ' VAL . 67.6 mt -60.87 -47.85 84.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.178 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 97' ' ' ASP . 45.5 t -64.59 -40.12 87.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.764 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -57.61 -44.96 85.86 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.856 179.376 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -59.7 -41.88 91.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.628 HG11 ' HB3' ' A' ' 10' ' ' CYS . 25.8 t -72.28 -37.8 59.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.409 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.506 HG11 ' CE1' ' A' ' 61' ' ' PHE . 21.6 t -125.52 104.15 12.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 120.873 0.368 . . . . 0.0 110.823 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 2.9 mt-30 -109.23 -40.38 4.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.095 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -86.62 85.5 7.3 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.059 0.457 . . . . 0.0 111.109 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -133.61 160.41 37.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.982 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.65 -51.18 29.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.03 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.8 161.7 3.87 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 6.6 pt-20 -148.08 150.04 33.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.051 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.618 ' CE1' HD11 ' A' ' 114' ' ' ILE . 12.2 p90 -157.41 160.79 38.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.152 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.439 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 10.2 p -102.32 142.59 16.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.99 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.618 HD11 ' CE1' ' A' ' 112' ' ' PHE . 3.9 mt -134.68 141.85 42.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.063 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 t -135.15 31.26 3.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.848 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.566 ' H ' HG22 ' A' ' 114' ' ' ILE . 30.4 t70 -145.12 136.55 25.18 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.705 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -59.0 -36.56 75.12 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.68 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -69.17 -44.7 71.69 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.556 0.217 . . . . 0.0 110.84 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.431 ' HB2' HG23 ' A' ' 114' ' ' ILE . 45.1 mt-10 -73.35 -31.22 63.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.159 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.405 ' N ' HG21 ' A' ' 114' ' ' ILE . 3.5 tp -74.0 -28.55 61.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.09 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -45.45 133.18 7.63 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.448 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -51.14 -32.15 22.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.1 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -56.71 -41.38 77.31 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.976 0.417 . . . . 0.0 110.29 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -70.43 -46.01 64.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.903 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.476 HG21 HD11 ' A' ' 79' ' ' ILE . 20.1 mm -61.14 -46.12 97.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.228 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -60.53 -37.87 82.58 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.619 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.62 -42.26 74.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.657 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.16 -43.13 99.36 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.093 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.721 HD11 ' HB2' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -65.73 -43.4 89.13 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.237 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 40.2 tttt . . . . . 0 CA--C 1.53 0.176 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.16 179.926 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.234 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -134.48 167.37 20.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.025 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -123.29 122.82 66.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.426 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 4.0 t70 -75.31 107.18 7.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -70.31 -36.88 74.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.777 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -66.75 -46.64 74.75 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.91 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.809 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -64.77 -51.63 61.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.302 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.2 t -55.48 -44.8 76.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -65.77 -44.01 87.15 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.77 -49.61 47.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.131 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.705 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -70.56 -36.87 73.88 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.651 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -55.35 -55.1 35.42 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.54 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.443 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 21.6 p30 -75.23 -20.97 58.95 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.3 -44.18 46.94 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.612 0.244 . . . . 0.0 111.318 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 13' ' ' ALA . 19.4 t -72.5 -40.16 62.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.513 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -59.16 -25.75 64.17 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.49 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.807 0.337 . . . . 0.0 110.797 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.989 0.423 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.2 t -129.0 108.42 17.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.033 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.463 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.2 pt -106.32 -29.89 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.651 ' HB2' HG22 ' A' ' 62' ' ' VAL . 31.0 p-90 -135.16 155.99 49.76 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.928 0.394 . . . . 0.0 111.179 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 16.7 m -141.38 149.05 20.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.225 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.533 HG22 ' H ' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -92.68 175.94 6.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.59 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.556 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 5.6 m-85 -144.82 104.73 4.04 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.007 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.98 -179.2 4.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.401 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -84.09 163.74 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.52 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.453 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -147.36 84.63 1.57 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.817 179.333 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 75.15 -68.64 2.0 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.303 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -156.68 34.88 0.31 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.8 t -158.39 158.46 34.28 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.428 HG12 ' OD2' ' A' ' 97' ' ' ASP . 3.6 mt -84.93 134.6 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.12 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.458 ' HB ' ' HD2' ' A' ' 38' ' ' PRO . 30.7 m -147.54 157.36 44.85 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.009 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.809 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.9 Cg_endo -65.88 171.37 9.99 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.335 2.023 . . . . 0.0 112.146 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.498 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -135.91 -151.91 6.25 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.53 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.531 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.35 140.27 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.418 0.687 . . . . 0.0 112.248 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -135.33 100.94 4.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.184 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.52 161.5 24.48 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.128 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.463 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.56 -26.75 34.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 0.0 110.52 179.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -96.04 122.42 38.85 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.533 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -68.2 -18.09 64.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.905 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.719 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -47.58 -40.12 18.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.623 0.249 . . . . 0.0 110.973 179.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.19 -39.66 91.03 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.226 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 39.8 t80 -66.43 -47.6 72.67 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.893 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.719 HD12 ' HA ' ' A' ' 46' ' ' GLN . 4.9 mt -58.18 -38.5 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.714 0.292 . . . . 0.0 110.781 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.41 -36.38 83.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.574 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.06 -23.44 22.55 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.599 ' SG ' HD22 ' A' ' 120' ' ' LEU . 0.4 OUTLIER -73.46 81.97 1.45 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.212 -179.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.2 p -109.48 146.13 35.09 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.638 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.583 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.7 m-20 -80.07 70.14 6.61 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.01 0.433 . . . . 0.0 111.385 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.706 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.9 t70 -165.5 45.08 0.08 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.204 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.765 HG13 ' N ' ' A' ' 57' ' ' ARG . 2.9 p 178.29 -147.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.765 ' N ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -163.71 123.41 2.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.392 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.1 pp -158.85 156.8 30.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.878 0.371 . . . . 0.0 111.322 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.556 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 67.3 m-85 -99.69 172.21 7.41 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.554 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -150.22 156.22 41.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -147.24 122.11 9.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.68 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.651 HG22 ' HB2' ' A' ' 26' ' ' TRP . 14.8 t -130.98 143.05 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-O 120.888 0.375 . . . . 0.0 111.507 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.478 ' HD2' HG12 ' A' ' 17' ' ' VAL . 60.7 mtt85 -121.71 112.67 18.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.551 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.598 ' HD2' HD22 ' A' ' 129' ' ' LEU . 16.2 m-85 -95.45 165.52 12.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.269 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.777 179.805 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.839 0.352 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.534 ' HG2' HD23 ' A' ' 129' ' ' LEU . 2.2 tptt -130.25 162.04 29.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.932 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.428 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 14.7 m-85 -130.37 146.92 52.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.617 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.593 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -146.76 111.51 5.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.494 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 14.8 tp -103.48 86.74 2.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.895 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.725 HG21 HD12 ' A' ' 114' ' ' ILE . 2.2 mp -96.26 141.4 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.249 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.7 m -114.35 124.18 51.34 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.431 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.52 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 68.7 t-105 -94.18 133.55 37.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.834 0.349 . . . . 0.0 110.745 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.512 ' O ' HG23 ' A' ' 82' ' ' ILE . 3.0 tt -128.33 90.82 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.837 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.583 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.56 111.33 4.06 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.709 -0.757 . . . . 0.0 111.692 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -37.07 -45.84 0.63 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -178.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.706 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.1 m-80 -73.68 46.54 0.22 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 90' ' ' GLN . 12.4 p -104.89 134.59 45.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.25 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 p -63.17 153.87 33.02 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.938 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.36 58.58 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 113.2 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -43.25 92.22 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.797 0.299 . . . . 0.0 111.073 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.469 ' HB2' HG22 ' A' ' 86' ' ' VAL . 31.5 mm-40 -67.68 -33.78 75.61 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.997 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.408 ' O ' HG22 ' A' ' 94' ' ' THR . 0.0 OUTLIER -57.4 -34.63 69.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.951 179.446 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.56 -33.93 27.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.949 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.5 tptt -56.13 -44.07 78.82 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.477 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.408 HG22 ' O ' ' A' ' 91' ' ' ARG . 8.6 t -61.35 -34.16 74.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.727 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.54 -48.88 82.16 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.06 -0.59 . . . . 0.0 112.103 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -38.44 86.35 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.568 0.223 . . . . 0.0 110.718 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.53 ' HA ' HD12 ' A' ' 100' ' ' LEU . 4.5 m-20 -60.98 -44.88 96.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.099 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.4 ttpt -58.79 -29.9 67.18 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.8 m -71.99 -45.37 61.23 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.448 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 97' ' ' ASP . 6.2 mt -62.33 -47.65 83.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.098 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.414 ' HA ' HG12 ' A' ' 104' ' ' VAL . 12.5 p -66.2 -32.77 59.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -68.46 -38.18 80.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.763 0.316 . . . . 0.0 110.837 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -47.22 68.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.784 HG13 HG23 ' A' ' 105' ' ' VAL . 14.8 p -71.04 -33.13 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.642 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.784 HG23 HG13 ' A' ' 104' ' ' VAL . 21.9 t -109.17 91.87 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.939 0.399 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -98.83 -35.96 9.95 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.046 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -79.43 79.78 5.86 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 110.829 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -127.84 -179.78 5.13 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -114.11 -50.98 2.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.344 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -145.16 150.96 37.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 7.7 pt-20 -151.99 128.39 10.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.573 ' HE2' HD11 ' A' ' 114' ' ' ILE . 16.4 p90 -159.78 159.43 32.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.341 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.73 146.1 7.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.727 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.725 HD12 HG21 ' A' ' 79' ' ' ILE . 58.7 mt -132.85 144.71 35.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.11 31.26 2.43 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.078 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.532 ' H ' HG22 ' A' ' 114' ' ' ILE . 38.6 t70 -147.07 140.54 25.54 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.916 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.501 ' HA ' HD21 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -60.9 -34.96 75.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.462 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.1 tttm -75.3 -37.85 60.62 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.73 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.48 ' CB ' HG23 ' A' ' 114' ' ' ILE . 30.7 mt-10 -67.2 -45.09 77.91 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.825 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.599 HD22 ' SG ' ' A' ' 52' ' ' CYS . 4.5 pp -72.02 -22.15 61.45 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.343 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -48.27 133.57 15.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.769 0.319 . . . . 0.0 110.874 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -49.15 -34.09 13.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.058 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -60.09 -46.29 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.894 0.378 . . . . 0.0 110.285 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -68.51 -44.23 75.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.107 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.412 HG22 HD13 ' A' ' 129' ' ' LEU . 37.5 mm -59.85 -45.24 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.13 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -57.34 -39.85 76.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.105 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.7 t -71.52 -46.19 60.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.727 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -57.08 -39.84 75.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.598 HD22 ' HD2' ' A' ' 64' ' ' PHE . 1.9 mp -72.51 -37.75 68.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.522 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 45.5 tptt . . . . . 0 C--O 1.232 0.175 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.5 -179.609 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -104.86 162.28 13.46 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.09 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -118.73 135.45 59.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.07 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.32 115.02 22.83 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.4 -41.64 93.44 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.078 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.32 -44.78 78.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.147 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.672 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -60.24 -59.57 5.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.238 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.8 m -55.73 -43.68 76.82 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.384 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -65.02 -41.66 95.08 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.484 ' HA ' ' ND2' ' A' ' 15' ' ' ASN . . . -55.18 -55.53 30.21 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.845 0.355 . . . . 0.0 110.733 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.504 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -59.59 -38.49 81.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.674 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -57.68 -50.53 72.88 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.484 ' ND2' ' HA ' ' A' ' 12' ' ' ALA . 13.0 p30 -62.13 -29.49 70.37 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.84 -45.36 15.65 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.691 0.281 . . . . 0.0 111.34 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.689 HG11 HG11 ' A' ' 27' ' ' VAL . 27.1 m -64.82 -29.75 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.698 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -56.62 -40.07 74.73 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.177 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.5 t70 . . . . . 0 C--O 1.233 0.185 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.604 179.631 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 41' ' ' GLN . 60.3 t -139.13 114.54 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.74 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.483 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.3 pt -110.97 -27.56 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 40.8 p-90 -128.19 161.82 28.41 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.883 0.373 . . . . 0.0 111.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.689 HG11 HG11 ' A' ' 17' ' ' VAL . 0.8 OUTLIER -144.07 151.87 16.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.521 179.178 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.455 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 64.0 m -93.21 161.08 14.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.692 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -146.12 99.24 3.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.997 0.427 . . . . 0.0 110.274 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.23 -179.57 5.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.703 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.925 ' HB3' HD13 ' A' ' 36' ' ' ILE . 52.2 p90 -131.54 132.94 44.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.204 0.526 . . . . 0.0 111.547 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -104.03 114.0 27.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.238 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.67 -74.35 1.78 Allowed Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.998 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 m -162.09 33.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.542 0.21 . . . . 0.0 111.515 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.4 p -140.7 134.58 30.55 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.851 0.357 . . . . 0.0 111.039 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.925 HD13 ' HB3' ' A' ' 31' ' ' TYR . 39.9 mm -81.69 130.9 35.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.814 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.448 HG12 ' CB ' ' A' ' 9' ' ' ALA . 16.7 m -152.62 142.59 15.01 Favored Pre-proline 0 C--O 1.233 0.212 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.213 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.672 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 38.2 Cg_exo -60.24 165.7 10.4 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.504 2.136 . . . . 0.0 112.276 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.455 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -134.95 -149.05 5.8 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.449 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.449 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.1 mp0 -34.88 136.48 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.388 0.675 . . . . 0.0 112.514 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.411 ' HB3' HG11 ' A' ' 24' ' ' VAL . 14.2 mt-30 -137.32 98.87 3.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.281 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.68 165.85 27.09 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.415 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.483 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.32 -22.04 33.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.679 -0.26 . . . . 0.0 110.79 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -88.45 109.44 20.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.537 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -66.86 -21.12 66.02 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.4 -39.2 21.67 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.767 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.51 -36.97 84.25 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.3 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 45.9 t80 -70.11 -42.08 73.13 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.903 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 63.3 mt -60.51 -40.41 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.753 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -70.8 -36.15 72.86 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.438 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -34.34 58.59 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.695 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.29 82.96 1.38 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 111.656 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.16 155.9 25.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.77 11.27 6.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.757 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -128.25 53.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.833 0.349 . . . . 0.0 110.912 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.48 153.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.143 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.72 ' HB3' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -111.18 143.1 42.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.738 179.289 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -160.55 177.22 10.74 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.785 0.326 . . . . 0.0 111.591 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -116.49 158.73 23.13 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.937 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -147.99 164.27 34.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.985 0.421 . . . . 0.0 111.614 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.437 ' CE2' HG11 ' A' ' 105' ' ' VAL . 2.4 t80 -150.81 121.48 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.242 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 39.7 t -124.96 134.34 67.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.601 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -93.08 113.8 26.15 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.217 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.4 143.22 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.373 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.423 ' O ' HG23 ' A' ' 65' ' ' THR . 5.6 t . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.497 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.596 0.236 . . . . 0.0 110.677 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -144.79 157.07 44.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.874 0.369 . . . . 0.0 111.366 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 15.5 m-85 -110.78 137.81 47.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.591 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.74 128.54 37.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.27 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 79' ' ' ILE . 1.4 tt -89.78 132.19 35.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.443 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 125' ' ' ILE . 14.8 mt -123.92 125.02 70.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.496 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.745 ' HB ' HG12 ' A' ' 113' ' ' VAL . 8.9 m -106.54 119.82 40.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.093 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.62 ' CE3' HD12 ' A' ' 120' ' ' LEU . 37.6 t-105 -98.52 137.4 37.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 111.498 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.511 HG23 HG11 ' A' ' 86' ' ' VAL . 53.3 mt -137.4 87.27 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.932 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.5 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -63.2 106.46 1.33 Allowed Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.785 -0.643 . . . . 0.0 113.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 1.02 -65.22 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 30.4 m-80 -45.94 -21.66 0.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.72 HG21 ' HB3' ' A' ' 57' ' ' ARG . 53.5 t -54.53 107.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.615 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 m -74.3 173.07 10.73 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.33 -43.15 57.37 Favored Glycine 0 C--N 1.336 0.567 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.061 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.58 -46.99 73.83 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.713 0.292 . . . . 0.0 110.808 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.693 ' HB3' HG13 ' A' ' 86' ' ' VAL . 9.3 mp0 -68.24 -37.67 81.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.358 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.428 ' O ' HG22 ' A' ' 94' ' ' THR . 7.6 mmt180 -58.03 -35.87 71.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 -38.91 71.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.93 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -59.72 -49.05 79.23 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.164 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.486 ' HB ' ' HD2' ' A' ' 57' ' ' ARG . 9.2 t -61.04 -33.38 73.21 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.23 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.72 93.65 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.963 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.18 -38.72 66.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.56 0.219 . . . . 0.0 110.498 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -58.19 -41.4 83.87 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.344 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -55.79 -33.68 64.6 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.745 0.307 . . . . 0.0 110.648 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.2 m -70.52 -44.43 67.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.426 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 61.9 mt -58.38 -49.35 77.56 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.674 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.1 t -64.98 -38.85 83.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.022 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 ttmt -60.95 -44.34 97.41 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.145 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -58.42 -45.34 88.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.69 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 t -74.89 -41.05 46.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.674 HG13 ' HE2' ' A' ' 14' ' ' TYR . 38.8 t -104.53 74.48 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 121.067 0.461 . . . . 0.0 110.754 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -77.62 -26.37 50.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.418 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.98 83.57 5.86 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.843 0.354 . . . . 0.0 110.73 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -132.42 158.43 42.02 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -110.51 -48.93 3.1 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.341 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.55 116.7 7.88 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.026 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -122.32 131.21 53.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.964 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -158.01 154.95 28.52 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.028 0.442 . . . . 0.0 111.51 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.745 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.3 m -89.68 156.28 3.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.357 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.57 HG22 ' H ' ' A' ' 116' ' ' ASP . 57.8 mt -138.51 140.6 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.955 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -124.25 13.35 8.93 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.78 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.57 ' H ' HG22 ' A' ' 114' ' ' ILE . 8.7 p-10 -148.44 144.28 27.32 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.942 0.401 . . . . 0.0 110.871 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -60.27 -29.71 68.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.989 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -46.75 88.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.731 0.301 . . . . 0.0 110.855 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.422 ' CB ' HG23 ' A' ' 114' ' ' ILE . 1.0 OUTLIER -74.26 -25.81 59.84 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.621 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.62 HD12 ' CE3' ' A' ' 81' ' ' TRP . 0.4 OUTLIER -83.41 -22.77 32.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.675 0.274 . . . . 0.0 111.045 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.431 ' HG2' ' OD1' ' A' ' 123' ' ' ASN . 12.5 tt0 -54.48 133.13 45.81 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.76 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -49.15 -45.08 43.29 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.177 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.431 ' OD1' ' HG2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -58.48 -32.79 69.1 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.25 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.414 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 20.6 t80 -74.81 -51.01 15.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.824 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 79' ' ' ILE . 21.6 mt -59.0 -48.18 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.071 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -55.0 -38.6 68.06 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.9 t -66.09 -49.11 68.69 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.04 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -60.26 -50.27 74.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.91 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.09 -37.19 84.12 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.4 tttp . . . . . 0 N--CA 1.464 0.229 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.612 -179.576 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.796 0.331 . . . . 0.0 110.743 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -100.25 147.21 26.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.516 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.447 ' HB ' HD13 ' A' ' 100' ' ' LEU . 2.9 tt -124.68 131.05 73.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -89.08 108.11 19.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.565 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -67.9 -34.05 75.89 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.153 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -54.89 40.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.218 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -67.97 -46.28 71.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.339 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 m -58.32 -45.09 88.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.302 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -68.77 -45.08 72.31 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.52 -46.66 73.56 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.781 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.569 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -62.07 -47.62 83.84 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -56.2 -43.32 78.37 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.143 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -59.44 -46.17 89.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.55 HD22 ' NE2' ' A' ' 41' ' ' GLN . 1.4 tt -65.31 -43.75 90.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.826 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 13' ' ' ALA . 47.6 t -66.72 -31.18 52.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.729 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -37.71 70.57 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.699 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.234 0.256 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.703 179.539 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.45 ' O ' HG23 ' A' ' 25' ' ' ILE . . . . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.5 t -54.77 118.54 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.604 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 43' ' ' ALA . 31.7 pt -113.78 -36.29 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.718 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.688 ' CB ' HG22 ' A' ' 62' ' ' VAL . 37.3 p-90 -136.21 157.61 46.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.037 0.446 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.422 ' CG2' HG21 ' A' ' 17' ' ' VAL . 4.6 m -138.64 144.74 29.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.473 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.447 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 97.5 m -84.9 162.53 19.43 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.553 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.53 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 6.9 m-85 -144.75 96.41 2.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.127 0.489 . . . . 0.0 110.21 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.436 ' HB3' HD22 ' A' ' 58' ' ' LEU . 1.5 pttt -125.86 179.93 4.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.681 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.733 ' HB3' HD13 ' A' ' 36' ' ' ILE . 51.1 p90 -109.4 125.4 52.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.926 0.393 . . . . 0.0 111.301 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.84 101.04 12.83 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.02 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.12 -68.89 2.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.887 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.7 p -160.17 33.08 0.17 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.633 0.254 . . . . 0.0 111.231 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -149.91 131.06 14.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.733 HD13 ' HB3' ' A' ' 31' ' ' TYR . 37.6 mm -71.31 129.68 35.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.986 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.463 HG12 ' HB3' ' A' ' 9' ' ' ALA . 4.0 m -152.22 157.43 33.95 Favored Pre-proline 0 C--O 1.234 0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.111 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 29.4 Cg_endo -62.46 162.59 23.57 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.653 2.236 . . . . 0.0 112.499 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.447 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -138.22 -146.93 5.11 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.706 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.507 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 1.9 mp0 -30.3 133.88 0.06 Allowed 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.499 0.719 . . . . 0.0 112.895 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.55 ' NE2' HD22 ' A' ' 16' ' ' LEU . 6.7 tt0 -131.42 101.14 5.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.001 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.03 165.32 25.16 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.503 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.479 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.37 -12.13 33.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.254 0.222 . . . . 0.0 111.464 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -116.08 134.04 55.37 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.668 0.271 . . . . 0.0 110.542 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -69.96 -19.16 63.37 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.894 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -49.81 -40.12 40.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.651 0.262 . . . . 0.0 110.84 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -36.16 79.22 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.403 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' ALA . 42.2 t80 -64.78 -61.12 2.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 121.289 -0.164 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 40.6 mt -57.59 -30.77 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.159 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -47.0 85.8 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.905 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -99.57 -0.16 41.03 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -88.45 88.83 7.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.036 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.1 156.86 17.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.921 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.505 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.1 p-10 -80.48 62.44 4.58 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.512 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.775 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.2 t0 -161.62 43.45 0.15 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.314 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.775 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.86 153.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.722 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.7 127.3 52.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.327 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' A' ' 30' ' ' LYS . 13.4 mt -142.58 156.38 45.09 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.924 0.392 . . . . 0.0 111.671 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.53 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 78.9 m-85 -104.29 161.22 14.23 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.186 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.438 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -154.15 146.47 23.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.879 0.371 . . . . 0.0 111.505 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -128.56 110.7 12.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.523 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.688 HG22 ' CB ' ' A' ' 26' ' ' TRP . 18.2 t -125.93 131.13 72.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.889 0.376 . . . . 0.0 111.361 -179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.9 mtm-85 -88.3 151.48 22.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.692 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -127.83 158.98 36.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.2 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.732 179.716 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.751 0.31 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -143.3 157.0 44.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.62 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 6.4 m-85 -107.49 147.74 30.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.71 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.457 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -147.7 115.81 6.52 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.445 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 5.6 tt -94.21 106.48 18.45 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.179 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.595 HG23 HD12 ' A' ' 114' ' ' ILE . 29.0 mm -94.67 120.95 44.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.285 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.481 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.1 OUTLIER -106.95 123.81 48.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.252 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.602 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 40.9 t-105 -105.85 136.01 46.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.04 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.464 HG22 HG21 ' A' ' 86' ' ' VAL . 36.7 mt -137.6 93.36 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.505 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -64.38 112.28 4.86 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.573 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.407 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.6 mt-10 -24.72 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.719 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.3 m-80 -72.16 43.23 0.1 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.577 HG13 ' HB3' ' A' ' 90' ' ' GLN . 11.6 t -75.77 126.87 36.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.596 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.5 p -73.11 163.74 27.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.991 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.08 -38.77 39.96 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 121.215 -0.517 . . . . 0.0 113.084 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.6 mp -81.6 -40.52 22.88 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.577 ' HB3' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -58.01 -37.32 74.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.458 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -41.39 89.11 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.628 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.27 -38.54 78.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.753 179.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -52.87 -41.45 64.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.21 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 m -52.51 -46.78 66.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.376 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.7 -47.71 74.02 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.917 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -45.51 90.61 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.989 0.395 . . . . 0.0 111.008 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.448 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 78.6 m-20 -64.69 -39.21 93.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.318 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -57.27 -33.6 67.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.767 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.1 m -71.33 -48.7 48.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.557 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.687 ' O ' HG23 ' A' ' 104' ' ' VAL . 52.6 mt -56.04 -51.69 66.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 97' ' ' ASP . 44.1 t -60.81 -39.55 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.143 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -55.0 -41.92 71.86 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.999 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.84 -34.08 66.56 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.228 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 100' ' ' LEU . 33.8 t -67.64 -47.08 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.531 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 26.4 t -106.89 114.98 47.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -107.24 -29.08 9.53 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.283 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -93.83 88.0 5.61 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.737 0.303 . . . . 0.0 111.03 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -141.61 168.75 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -101.38 -53.87 2.9 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.456 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -150.34 147.44 27.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.605 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 5.2 pt-20 -142.88 120.12 11.52 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.61 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -145.84 148.47 32.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.874 0.368 . . . . 0.0 111.262 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.481 HG12 ' HB ' ' A' ' 80' ' ' THR . 6.1 m -81.31 160.59 3.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.474 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.714 HD13 ' HA ' ' A' ' 120' ' ' LEU . 77.3 mt -141.09 132.86 28.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.103 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 m -116.61 -17.65 10.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.846 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.47 151.99 32.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.891 0.377 . . . . 0.0 111.176 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.492 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 32.1 ttp180 -64.2 -26.41 68.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.615 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 6.9 tptp -68.31 -38.06 81.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.993 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.67 ' CB ' HG23 ' A' ' 114' ' ' ILE . 1.2 mt-10 -73.4 -39.31 65.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.646 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.714 ' HA ' HD13 ' A' ' 114' ' ' ILE . 4.2 pp -74.77 -15.97 60.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.251 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -51.46 130.15 26.87 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.986 0.422 . . . . 0.0 110.697 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -48.05 -44.74 31.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.714 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -62.8 -41.31 99.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.939 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 32.9 t80 -59.47 -52.24 66.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.22 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.526 HG21 HD11 ' A' ' 79' ' ' ILE . 11.5 mt -55.21 -42.9 68.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -57.29 -40.99 78.92 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 32.6 t -69.27 -41.96 76.17 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.71 88.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.253 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.457 HD21 ' HB2' ' A' ' 77' ' ' ALA . 4.7 mp -71.05 -33.03 69.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.53 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 37.4 tttt . . . . . 0 C--O 1.233 0.197 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.326 -179.632 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.617 HG23 ' HE2' ' A' ' 93' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.831 0.348 . . . . 0.0 111.068 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -136.52 145.04 44.62 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.531 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.526 HD12 HD11 ' A' ' 36' ' ' ILE . 13.9 tt -112.72 128.67 69.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 6.1 t0 -75.69 102.49 5.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.556 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -34.59 74.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.009 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -69.6 -50.12 47.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.898 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.517 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -62.46 -54.26 42.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.3 t -56.02 -37.09 68.71 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.813 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -60.04 -52.61 64.62 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.59 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -52.85 -48.77 66.82 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.126 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.545 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -58.27 -36.42 73.23 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.59 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.542 ' CE2' HG13 ' A' ' 105' ' ' VAL . 0.4 OUTLIER -60.86 -62.08 2.12 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.267 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -62.55 -33.44 74.94 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -60.94 -48.39 82.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.675 0.274 . . . . 0.0 110.819 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 13' ' ' ALA . 49.0 t -72.58 -30.66 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.46 -36.71 64.4 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.987 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 t70 . . . . . 0 C--O 1.232 0.174 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.58 179.6 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.272 0 CA-C-O 121.054 0.454 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.3 t -141.48 104.46 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.0 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.439 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -108.62 -26.37 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.563 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.424 ' HD1' HD11 ' A' ' 25' ' ' ILE . 26.8 p-90 -135.65 157.9 45.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.859 0.361 . . . . 0.0 111.333 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.572 HG22 ' HB3' ' A' ' 61' ' ' PHE . 27.0 m -140.99 150.06 20.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.268 179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.418 HG22 ' H ' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -97.47 174.71 6.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.967 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.418 ' H ' HG22 ' A' ' 28' ' ' THR . 2.3 m-85 -149.39 96.02 2.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.187 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.06 175.23 5.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.419 -179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.578 ' CE1' HG23 ' A' ' 36' ' ' ILE . 0.8 OUTLIER -104.18 120.7 41.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.912 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -102.54 89.82 3.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.201 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.63 -79.62 1.38 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.146 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.25 32.06 1.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.786 0.327 . . . . 0.0 111.21 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.6 t -154.36 148.87 26.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.663 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.578 HG23 ' CE1' ' A' ' 31' ' ' TYR . 5.7 pt -90.04 135.36 26.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.952 0.406 . . . . 0.0 111.232 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.502 HG13 ' CB ' ' A' ' 9' ' ' ALA . 44.6 t -141.98 139.35 18.01 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.602 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.517 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 9.9 Cg_endo -51.07 153.16 9.48 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.61 2.207 . . . . 0.0 112.248 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -126.17 -152.96 8.25 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.653 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.0 mp0 -34.05 139.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.562 0.745 . . . . 0.0 112.682 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' HG2' HG12 ' A' ' 27' ' ' VAL . 11.7 mt-30 -134.42 94.64 3.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.217 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.08 165.58 21.79 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.782 -0.723 . . . . 0.0 113.301 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.439 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -90.59 -19.94 23.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.587 0.232 . . . . 0.0 110.962 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.72 126.24 38.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.766 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.462 ' HD2' HD11 ' A' ' 49' ' ' ILE . 42.5 t80 -74.03 -16.64 61.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.889 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -51.33 -41.01 60.27 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.657 0.265 . . . . 0.0 111.043 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.01 -29.48 67.66 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.239 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.609 ' HE2' ' HB1' ' A' ' 60' ' ' ALA . 32.4 t80 -63.37 -45.36 91.53 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.716 0.293 . . . . 0.0 110.825 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.462 HD11 ' HD2' ' A' ' 45' ' ' TYR . 3.5 mt -69.13 -42.96 81.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.093 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -55.39 -47.08 76.4 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.483 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -75.94 -33.77 59.84 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.479 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -72.83 81.05 1.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.849 0.357 . . . . 0.0 111.332 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.3 p -107.45 144.92 33.7 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.565 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.05 65.85 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.347 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.799 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -157.83 38.86 0.27 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.417 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.799 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 161.95 163.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.252 0.621 . . . . 0.0 110.365 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.726 ' HB3' HG11 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -107.98 124.65 50.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.47 179.057 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 pp -147.94 145.28 28.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.089 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 97' ' ' ASP . 3.4 m-85 -90.59 166.59 13.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.609 ' HB1' ' HE2' ' A' ' 48' ' ' PHE . . . -153.78 172.33 17.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.134 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.572 ' HB3' HG22 ' A' ' 27' ' ' VAL . 1.5 t80 -152.31 138.47 18.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.2 t -143.52 137.65 25.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.003 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -102.86 127.64 49.97 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.662 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -117.04 159.19 22.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.902 0.382 . . . . 0.0 111.332 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.711 179.526 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.644 0.259 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -141.19 129.14 21.88 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.552 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 70.3 m-85 -85.3 141.1 30.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.66 114.13 17.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.732 HD11 HG11 ' A' ' 101' ' ' VAL . 0.5 OUTLIER -94.96 106.46 18.45 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.542 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.444 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 25.6 mm -103.15 115.22 44.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.438 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.459 HG21 HG22 ' A' ' 113' ' ' VAL . 5.2 t -109.16 110.66 21.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.324 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -86.5 140.08 30.27 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.509 HG23 ' HB3' ' A' ' 115' ' ' SER . 2.7 tt -128.16 84.57 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.352 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.508 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -67.62 116.95 8.3 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.889 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.0 mm-40 -33.54 -31.68 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.751 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.5 m-80 -73.58 36.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.454 0.57 . . . . 0.0 111.727 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.726 HG11 ' HB3' ' A' ' 57' ' ' ARG . 3.7 m -102.04 113.32 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 70.9 m -65.52 174.28 2.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.952 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -49.18 -45.99 34.37 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.933 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -47.81 80.58 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.674 0.273 . . . . 0.0 110.982 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -63.2 -37.72 88.33 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.106 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -50.66 71.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.775 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.96 72.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.542 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.617 ' HE2' HG23 ' A' ' 3' ' ' THR . 0.3 OUTLIER -56.57 -36.87 69.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.248 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.3 -47.5 85.17 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.832 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.85 -46.55 93.89 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.016 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.649 ' O ' HG22 ' A' ' 99' ' ' THR . 4.0 m -63.81 -33.12 74.96 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.784 0.326 . . . . 0.0 110.722 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.553 ' O ' HG23 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -69.78 -31.18 68.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -34.29 74.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.678 0.275 . . . . 0.0 110.897 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.649 HG22 ' O ' ' A' ' 96' ' ' THR . 7.4 t -83.68 -33.24 25.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.276 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 97' ' ' ASP . 21.1 mt -68.08 -47.76 67.38 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.809 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.732 HG11 HD11 ' A' ' 78' ' ' LEU . 37.9 t -68.74 -38.02 78.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.366 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -63.23 -39.46 94.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.704 0.287 . . . . 0.0 110.656 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -65.35 -50.61 64.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.971 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.868 HG13 HG23 ' A' ' 105' ' ' VAL . 14.9 p -71.22 -36.26 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.337 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.868 HG23 HG13 ' A' ' 104' ' ' VAL . 26.1 t -118.15 98.94 7.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.937 0.399 . . . . 0.0 110.837 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -100.95 -36.84 8.89 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.008 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -78.15 81.22 4.54 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 110.74 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -130.18 177.07 7.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.698 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -110.07 -52.58 2.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.112 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -154.95 143.77 20.78 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.894 0.378 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.528 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 13.4 pt-20 -148.06 126.53 12.39 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.529 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -143.79 168.01 20.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.39 . . . . 0.0 111.434 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.459 HG22 HG21 ' A' ' 80' ' ' THR . 4.7 t -107.09 130.08 59.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.466 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.632 HG22 ' H ' ' A' ' 116' ' ' ASP . 41.4 mm -127.51 148.27 32.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.132 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.509 ' HB3' HG23 ' A' ' 82' ' ' ILE . 47.7 p -138.14 30.94 2.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.992 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.632 ' H ' HG22 ' A' ' 114' ' ' ILE . 26.2 t70 -136.29 135.01 38.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.682 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.11 85.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.373 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -63.04 -47.68 81.99 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.479 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -69.71 -30.14 67.71 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.853 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -33.12 74.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.765 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -47.46 131.76 13.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.206 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -51.73 -32.63 31.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.884 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -58.19 -45.18 88.01 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.374 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -67.28 -47.34 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.012 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.87 -47.95 89.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -62.18 -41.76 98.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -45.44 93.26 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.727 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.45 -49.78 72.32 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -37.1 82.5 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.099 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 tttm . . . . . 0 C--O 1.232 0.179 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.948 179.632 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.834 0.35 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.445 ' O ' HD12 ' A' ' 36' ' ' ILE . 21.3 mttm -104.08 176.79 5.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.514 HD13 ' HA ' ' A' ' 101' ' ' VAL . 10.0 tt -118.16 123.84 72.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.7 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.468 ' HB3' HG12 ' A' ' 37' ' ' VAL . 7.3 t70 -67.4 111.01 3.82 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.424 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -45.36 88.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.33 -44.48 75.9 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.062 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.617 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.49 -54.9 29.03 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -58.19 -47.78 82.38 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.092 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -42.02 99.14 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.895 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.41 -49.42 74.56 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.837 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.447 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.79 -32.9 74.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.175 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -57.64 10.41 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.146 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -68.5 -31.32 70.49 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.572 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.5 -49.11 64.96 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.141 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 13' ' ' ALA . 59.2 t -71.0 -33.82 53.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.833 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -53.88 -35.58 61.73 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.988 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 . . . . . 0 C--O 1.232 0.154 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.259 179.402 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 N--CA 1.465 0.297 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.426 HG23 ' HB2' ' A' ' 41' ' ' GLN . 12.5 p -111.45 131.69 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.777 0.322 . . . . 0.0 111.634 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.543 HG12 ' HA ' ' A' ' 43' ' ' ALA . 18.0 pt -129.48 -41.55 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.638 ' CB ' HG22 ' A' ' 62' ' ' VAL . 27.9 p-90 -121.69 159.84 25.72 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.965 0.412 . . . . 0.0 111.802 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.61 HG12 ' HB3' ' A' ' 41' ' ' GLN . 12.4 m -142.84 148.08 20.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.588 178.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.612 HG22 ' HZ3' ' A' ' 26' ' ' TRP . 1.5 t -120.05 115.46 23.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.477 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 9.3 m-85 -79.64 121.1 24.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.607 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.71 164.75 17.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.87 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -78.66 113.26 16.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.899 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -132.42 108.93 9.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.664 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.54 37.63 58.11 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.521 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 m 64.38 26.85 13.62 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.706 0.288 . . . . 0.0 111.198 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -146.47 153.32 40.3 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.939 0.399 . . . . 0.0 110.735 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.445 HD12 ' O ' ' A' ' 4' ' ' LYS . 3.0 mp -84.08 128.88 38.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.468 HG12 ' HB3' ' A' ' 6' ' ' ASP . 19.6 m -145.11 144.92 25.16 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.884 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.617 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 36.5 Cg_exo -57.26 149.46 64.2 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -130.35 -153.47 7.73 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 121.21 -0.519 . . . . 0.0 112.467 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.581 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.9 mp0 -23.96 132.64 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.791 0.836 . . . . 0.0 112.74 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.61 ' HB3' HG12 ' A' ' 27' ' ' VAL . 1.7 pt20 -134.13 98.86 4.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.158 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.77 164.69 25.18 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.467 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 23' ' ' ALA . . . -88.34 -21.12 24.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.609 0.242 . . . . 0.0 110.805 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.12 115.36 28.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.729 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -68.35 -17.69 64.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.407 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.47 -40.84 27.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.664 0.269 . . . . 0.0 110.695 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -37.48 87.56 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.999 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.626 ' HZ ' ' HB2' ' A' ' 60' ' ' ALA . 5.8 t80 -67.84 -39.57 83.82 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.06 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 53.7 mt -68.46 -48.09 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.992 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.97 -36.19 76.6 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.685 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -24.61 27.49 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.528 ' SG ' HD21 ' A' ' 120' ' ' LEU . 1.3 m -74.66 82.39 2.05 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.829 0.347 . . . . 0.0 111.456 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.2 p -92.19 171.64 8.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.259 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.453 ' HB3' ' HG3' ' A' ' 84' ' ' GLU . 7.6 m-20 -86.27 19.06 2.85 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.563 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.694 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -134.79 71.95 1.45 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.674 0.273 . . . . 0.0 110.564 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.694 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -174.66 -172.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 120.939 0.399 . . . . 0.0 111.533 -179.363 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.79 102.67 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.18 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -149.53 177.64 9.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.528 ' CD1' HG23 ' A' ' 80' ' ' THR . 28.0 m-85 -110.36 171.79 7.25 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.626 ' HB2' ' HZ ' ' A' ' 48' ' ' PHE . . . -151.26 164.17 37.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.394 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -153.82 108.89 3.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.828 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.638 HG22 ' CB ' ' A' ' 26' ' ' TRP . 13.0 t -119.38 139.28 47.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -93.47 105.12 17.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.454 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.529 ' CG ' HD22 ' A' ' 129' ' ' LEU . 23.7 m-85 -84.69 141.84 30.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.756 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.851 0.358 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -138.88 139.54 38.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.753 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -104.77 123.57 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.878 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.633 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -136.64 136.01 38.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.15 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.429 HD21 ' HB3' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -107.33 106.59 17.1 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.379 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.413 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 2.0 mt -90.58 121.87 41.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.16 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.528 HG23 ' CD1' ' A' ' 59' ' ' PHE . 1.7 m -96.29 123.47 39.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.36 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.697 ' CE3' HD22 ' A' ' 120' ' ' LEU . 68.8 t-105 -111.13 134.38 52.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.891 0.377 . . . . 0.0 111.022 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 39.9 mt -137.75 105.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.031 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -68.84 116.57 7.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.624 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' HB3' ' A' ' 54' ' ' ASP . 0.1 OUTLIER -38.12 -30.34 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.657 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -72.94 36.24 0.08 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.031 0.444 . . . . 0.0 111.966 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.451 ' H ' ' C ' ' A' ' 84' ' ' GLU . 5.0 m -109.35 127.73 65.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.546 178.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.99 170.45 11.27 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.85 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.03 -42.17 47.38 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.672 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.4 -44.99 93.06 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.854 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -61.69 -41.73 97.97 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.878 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -61.23 -46.06 91.96 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.649 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.24 78.06 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.255 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -55.62 -55.05 36.56 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.856 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -38.55 71.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.58 -45.74 94.2 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.823 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.8 -45.37 36.43 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.668 0.234 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.887 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -59.76 -38.34 81.54 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.297 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -32.73 69.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.871 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.1 m -70.53 -42.73 70.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.441 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.887 HD12 ' HA ' ' A' ' 97' ' ' ASP . 6.4 mt -61.8 -50.07 73.81 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.084 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.514 ' HA ' HD13 ' A' ' 5' ' ' ILE . 13.0 p -62.65 -35.39 70.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.274 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -62.79 -41.79 99.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.714 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -62.83 -37.73 87.94 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.845 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 100' ' ' LEU . 39.7 t -63.79 -44.89 98.37 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.924 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -121.38 98.55 6.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -95.0 -24.85 16.74 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.555 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -80.16 83.65 5.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.787 0.327 . . . . 0.0 110.89 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -136.23 166.96 22.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.61 -55.35 2.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.318 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -132.74 147.65 52.32 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.288 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.429 ' HB3' HD21 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -152.0 124.58 8.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.992 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.611 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 13.4 p90 -158.55 161.1 37.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.382 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.455 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 8.7 p -109.31 140.39 28.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.781 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.587 HD11 ' HE1' ' A' ' 112' ' ' PHE . 8.5 mt -131.87 139.37 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 111.337 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.68 -26.24 10.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.947 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -83.9 138.67 33.05 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -35.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.525 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -68.19 -47.45 67.88 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.34 -27.9 68.25 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.204 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.697 HD22 ' CE3' ' A' ' 81' ' ' TRP . 1.3 tp -76.37 -28.48 56.79 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.6 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -50.59 135.17 23.39 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.102 0.477 . . . . 0.0 111.164 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.45 -31.65 46.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.121 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.38 -43.79 92.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.802 0.334 . . . . 0.0 110.599 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.38 -48.91 68.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.905 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.611 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 15.8 mt -61.96 -37.4 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.25 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.78 -40.49 63.24 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -73.08 -43.02 62.39 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.31 -49.41 74.1 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.185 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.633 HD11 ' CB ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -62.51 -45.47 92.85 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.271 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 43.2 tttt . . . . . 0 C--O 1.232 0.165 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.889 179.684 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.654 0.264 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -103.78 157.61 16.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.487 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.459 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.1 tt -128.73 118.83 48.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.471 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -79.97 112.01 16.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.918 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -37.41 58.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -55.37 35.56 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.099 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.679 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -59.53 -49.61 77.11 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.141 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.81 -46.88 84.05 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.899 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtt-85 -62.35 -46.31 89.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.926 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.16 -45.25 79.74 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.796 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.539 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -63.07 -46.52 87.06 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -56.3 -42.24 77.24 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.908 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.413 ' HA ' HD22 ' A' ' 16' ' ' LEU . 0.3 OUTLIER -65.13 -43.35 92.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.077 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.588 HG21 HG21 ' A' ' 27' ' ' VAL . 26.3 t -71.38 -31.05 42.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.259 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -39.38 58.91 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.929 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 C--O 1.233 0.22 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.608 179.456 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.307 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.6 t -114.46 132.16 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.746 0.308 . . . . 0.0 111.391 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.59 HG12 ' HA ' ' A' ' 43' ' ' ALA . 22.8 pt -129.67 -40.68 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.609 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.774 ' HB2' HG22 ' A' ' 62' ' ' VAL . 24.6 p-90 -123.74 154.24 39.76 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.879 0.371 . . . . 0.0 111.294 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.739 HG13 ' HG3' ' A' ' 41' ' ' GLN . 6.8 t -138.57 155.05 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.198 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.43 ' O ' ' N ' ' A' ' 39' ' ' GLY . 0.3 OUTLIER -98.63 169.91 9.17 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.545 179.246 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -150.91 95.87 2.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.995 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -122.01 170.03 10.24 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.969 0.414 . . . . 0.0 111.61 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -80.21 135.87 36.36 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.759 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.524 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.0 m-20 -153.7 116.52 4.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.09 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.83 40.29 75.22 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.928 -0.654 . . . . 0.0 113.014 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m 62.78 28.42 16.47 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.626 0.251 . . . . 0.0 111.494 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.5 t -156.0 149.1 24.39 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.6 mt -78.39 132.24 32.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.171 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.524 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 30.9 m -144.47 154.09 56.18 Favored Pre-proline 0 CA--C 1.531 0.217 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.679 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 36.5 Cg_endo -64.85 163.45 28.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.429 2.086 . . . . 0.0 112.306 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.18 -153.84 7.69 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.253 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.6 mp0 -36.13 141.74 0.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.739 ' HG3' HG13 ' A' ' 27' ' ' VAL . 8.1 mt-30 -135.71 111.71 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.85 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.75 168.11 34.85 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.543 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.59 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.08 -18.73 29.83 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.723 -0.239 . . . . 0.0 110.956 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.71 119.94 31.35 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.752 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.414 ' HD2' HD11 ' A' ' 49' ' ' ILE . 15.2 t80 -72.94 -23.11 60.64 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.611 ' HA ' HD12 ' A' ' 49' ' ' ILE . 15.8 tp60 -48.76 -37.33 18.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.637 0.256 . . . . 0.0 110.715 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -33.65 76.51 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.337 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.87 -42.54 63.57 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.687 0.28 . . . . 0.0 111.057 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 46' ' ' GLN . 9.6 mt -62.31 -40.55 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.137 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -69.2 -38.35 78.57 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.552 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.97 -42.73 60.04 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.44 -179.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 6.1 m -80.45 84.22 6.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.979 0.419 . . . . 0.0 111.803 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 p -96.89 161.8 13.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.551 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.489 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.5 m-20 -81.89 63.39 6.11 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.123 0.487 . . . . 0.0 111.299 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.744 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.8 t70 -170.08 43.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.741 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.744 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.1 150.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.525 -179.514 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.583 ' HD3' HG23 ' A' ' 94' ' ' THR . 0.0 OUTLIER -109.9 121.82 46.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.731 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.6 173.38 11.87 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -117.85 172.3 7.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.256 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.37 166.08 31.89 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.47 . . . . 0.0 111.667 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -144.77 112.21 6.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.824 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.774 HG22 ' HB2' ' A' ' 26' ' ' TRP . 17.5 t -126.14 137.14 58.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.932 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -119.45 124.95 47.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.59 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -111.99 161.8 16.05 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.266 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.233 0.231 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.375 179.289 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -148.16 138.42 22.72 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.947 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -94.07 147.08 23.48 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.552 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.54 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -143.53 142.04 30.97 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.596 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.93 105.15 16.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.389 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 25.4 mm -93.16 113.05 27.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.199 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.463 ' HB ' HG22 ' A' ' 113' ' ' VAL . 15.3 m -98.77 114.15 26.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.608 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -100.35 137.73 38.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.857 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.527 ' CG2' HG21 ' A' ' 86' ' ' VAL . 40.0 mt -138.57 97.37 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.489 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.95 109.7 3.06 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.382 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 86' ' ' VAL . 36.9 mt-10 -22.23 -46.34 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -179.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.736 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.2 m-80 -70.72 43.68 0.07 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.14 0.495 . . . . 0.0 111.935 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.527 HG21 ' CG2' ' A' ' 82' ' ' ILE . 4.1 t -78.61 145.51 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.277 178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.0 m -83.71 171.28 13.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.02 7.08 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.409 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mp -58.97 -37.3 76.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.72 0.295 . . . . 0.0 110.964 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.69 -34.88 77.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -30.42 71.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.538 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -85.07 -39.0 18.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.975 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -33.82 67.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.302 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.583 HG23 ' HD3' ' A' ' 57' ' ' ARG . 3.0 p -64.62 -42.09 95.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.543 0.211 . . . . 0.0 110.736 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.48 -49.44 76.65 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.12 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -73.64 -30.2 62.8 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 111.505 0.187 . . . . 0.0 111.505 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.646 ' HA ' HD12 ' A' ' 100' ' ' LEU . 9.9 t0 -58.69 -42.73 89.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.7 0.286 . . . . 0.0 111.039 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -53.77 -32.73 53.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.128 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.9 m -74.98 -41.5 59.41 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.006 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 97' ' ' ASP . 16.8 mt -61.66 -49.23 77.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.364 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.501 ' HA ' HG12 ' A' ' 104' ' ' VAL . 58.6 t -64.65 -37.65 80.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.911 179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -61.85 -34.96 76.92 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.042 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -75.18 -47.5 28.03 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.442 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.793 HG13 HG23 ' A' ' 105' ' ' VAL . 13.7 p -66.54 -38.32 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.499 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.793 HG23 HG13 ' A' ' 104' ' ' VAL . 43.7 t -127.8 121.5 56.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 120.772 0.32 . . . . 0.0 110.967 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -120.17 3.29 10.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.961 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -89.43 74.55 7.75 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.913 0.387 . . . . 0.0 111.073 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -145.8 147.69 32.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.148 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.82 -41.85 15.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.372 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.55 ' HD2' HD22 ' A' ' 129' ' ' LEU . 0.1 OUTLIER -152.28 160.47 43.34 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.813 0.339 . . . . 0.0 111.181 -179.776 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -150.6 122.64 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.892 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -137.47 166.22 24.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 111.123 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.463 HG22 ' HB ' ' A' ' 80' ' ' THR . 25.5 t -110.37 139.57 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.631 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.527 HG22 ' H ' ' A' ' 116' ' ' ASP . 32.7 mm -131.53 151.1 34.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.105 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.1 t -147.1 29.8 0.97 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.017 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.527 ' H ' HG22 ' A' ' 114' ' ' ILE . 35.4 t70 -137.52 136.08 37.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.58 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.89 -35.91 82.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.289 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.8 tttm -65.9 -41.87 90.96 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.46 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -73.49 -33.11 64.66 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.59 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.428 ' HA ' HD23 ' A' ' 120' ' ' LEU . 5.0 mt -61.02 -34.15 74.39 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.432 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -43.43 130.31 5.03 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.333 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -49.69 -36.87 26.64 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.922 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -60.58 -42.6 97.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.893 0.378 . . . . 0.0 110.22 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -69.77 -49.71 50.37 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.952 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.4 mm -55.98 -46.51 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -66.81 -34.7 78.38 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.172 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.3 t -61.97 -48.81 78.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.828 0.347 . . . . 0.0 110.255 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.35 -32.21 71.15 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.712 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.55 HD22 ' HD2' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -53.44 -47.47 69.64 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.644 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.591 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -107.98 103.22 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.69 HD12 ' HB ' ' A' ' 36' ' ' ILE . 0.9 OUTLIER -80.01 113.37 19.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.556 179.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.419 ' HB3' HG12 ' A' ' 37' ' ' VAL . 16.7 t0 -72.02 106.79 4.42 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HD3' HG23 ' A' ' 104' ' ' VAL . 1.3 mmmp? -68.26 -40.3 81.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.676 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -60.98 -45.95 92.73 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.752 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -59.65 -57.05 14.61 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.633 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 46.3 t -57.17 -42.83 81.84 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -41.99 96.27 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.906 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.76 -52.85 58.89 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.926 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.457 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.43 -33.46 76.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.158 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.526 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -55.96 -57.13 13.4 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.334 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -69.9 -29.81 67.09 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.618 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.46 -48.51 79.3 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.645 0.26 . . . . 0.0 111.128 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 13' ' ' ALA . 47.7 t -69.4 -33.74 58.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.45 -18.3 60.66 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.823 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 111.249 -179.877 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.445 ' CG1' ' HB3' ' A' ' 41' ' ' GLN . 48.2 t -141.33 109.42 2.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.746 0.308 . . . . 0.0 110.849 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.41 HG12 ' HA ' ' A' ' 43' ' ' ALA . 2.2 pt -108.18 -28.84 2.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.542 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.563 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 43.9 p-90 -128.71 158.15 39.38 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.891 0.377 . . . . 0.0 111.312 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.619 HG12 ' HG2' ' A' ' 41' ' ' GLN . 29.2 m -142.34 143.99 25.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.154 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.561 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 3.6 m -82.38 168.09 17.86 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.472 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.452 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 7.7 m-85 -147.46 108.9 4.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 110.496 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -143.88 148.87 36.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 35' ' ' THR . 43.7 p90 -98.18 133.69 42.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.569 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.35 108.44 19.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.211 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.0 -71.37 2.21 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.123 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 p -159.8 33.71 0.18 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.205 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 3.3 t -145.47 126.39 14.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.69 ' HB ' HD12 ' A' ' 5' ' ' ILE . 33.3 mt -83.94 133.28 29.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.419 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.3 m -152.98 156.28 32.64 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.752 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.4 Cg_endo -65.86 160.05 45.88 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.6 2.2 . . . . 0.0 112.242 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.561 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.69 -146.67 6.09 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.494 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.563 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.29 137.32 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.083 0.553 . . . . 0.0 112.412 -179.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.619 ' HG2' HG12 ' A' ' 27' ' ' VAL . 14.3 mt-30 -135.22 114.44 12.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.329 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -149.99 160.94 28.72 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.757 -0.735 . . . . 0.0 113.338 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.41 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.12 -25.92 36.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.571 0.224 . . . . 0.0 110.815 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.42 121.37 38.15 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.511 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.92 -20.4 64.23 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -37.15 9.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.748 0.309 . . . . 0.0 111.042 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -42.96 99.48 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.678 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 56.4 t80 -66.88 -45.28 78.54 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.719 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 55.0 mt -61.42 -36.14 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -59.5 -47.06 86.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.016 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.88 -17.33 47.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.853 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.657 ' SG ' HD21 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -70.86 83.51 0.65 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.115 0.483 . . . . 0.0 111.592 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.2 p -111.09 146.21 37.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.458 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.516 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 2.3 m-20 -78.96 59.94 2.77 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.84 0.352 . . . . 0.0 111.699 -179.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.747 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.6 t70 -157.85 36.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.989 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.747 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -179.36 174.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.022 -179.759 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.569 ' HG2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -124.77 133.76 53.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.928 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.39 164.03 32.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.988 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.452 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 18.9 m-85 -105.87 166.19 10.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.925 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.678 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -143.87 155.52 44.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.578 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.449 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 1.2 t80 -152.07 135.53 16.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.503 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.21 141.93 12.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.855 0.36 . . . . 0.0 111.308 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD2' ' CE2' ' A' ' 76' ' ' PHE . 11.0 ttp180 -108.9 154.44 22.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.462 ' CD1' HD22 ' A' ' 129' ' ' LEU . 71.9 m-85 -125.47 150.47 47.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.656 179.859 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.702 0.286 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -139.83 143.63 36.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.156 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.48 ' CE2' ' HD2' ' A' ' 63' ' ' ARG . 5.5 m-85 -119.18 136.14 54.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.714 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -142.55 140.76 31.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.962 0.411 . . . . 0.0 111.718 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HG ' ' CD2' ' A' ' 61' ' ' PHE . 1.2 tt -109.15 119.66 40.2 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.241 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.451 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 2.2 mp -113.33 127.88 70.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 0.0 111.363 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.631 ' HB ' HG23 ' A' ' 113' ' ' VAL . 1.1 m -102.82 132.68 48.83 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.236 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.714 ' CE3' HD22 ' A' ' 120' ' ' LEU . 55.3 t-105 -109.36 123.96 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.902 0.382 . . . . 0.0 111.421 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.557 HD11 ' HD3' ' A' ' 91' ' ' ARG . 1.9 tt -114.91 100.32 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.861 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.516 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -71.35 73.2 0.75 Allowed Glycine 0 C--N 1.333 0.368 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.932 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 24.11 -75.22 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' A' ' 83' ' ' GLY . 49.5 m-80 -49.0 -18.06 0.26 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.548 HG21 HG13 ' A' ' 82' ' ' ILE . 16.7 t -36.75 109.24 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 O-C-N 123.229 0.33 . . . . 0.0 111.608 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.8 m -61.3 168.81 2.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.676 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.07 -48.25 86.83 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.467 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 89' ' ' LEU . 10.3 tp -57.34 -38.9 74.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.695 0.283 . . . . 0.0 110.533 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.569 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 24.5 mm-40 -68.73 -37.83 79.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.399 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.557 ' HD3' HD11 ' A' ' 82' ' ' ILE . 1.3 mmm180 -59.47 -51.45 69.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.431 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.53 87.71 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.94 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.98 -46.0 82.51 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.461 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 63.2 m -60.99 -44.46 97.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.72 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.22 -52.39 49.8 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.703 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.38 -37.43 85.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.59 0.233 . . . . 0.0 110.938 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.667 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.1 m-20 -57.91 -40.86 81.4 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.945 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -62.46 -29.75 70.75 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.015 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.6 m -67.79 -47.24 69.66 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.722 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' A' ' 97' ' ' ASP . 1.4 mt -61.98 -42.54 99.25 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.965 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 97' ' ' ASP . 41.0 t -67.96 -31.68 53.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.78 -41.12 96.09 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.932 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.45 -52.68 43.78 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.13 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.785 HG13 HG23 ' A' ' 105' ' ' VAL . 7.6 p -64.29 -34.27 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.3 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.785 HG23 HG13 ' A' ' 104' ' ' VAL . 41.1 t -119.29 89.92 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 120.912 0.387 . . . . 0.0 110.713 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -101.52 -24.37 14.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -77.63 84.17 4.0 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.923 0.392 . . . . 0.0 110.841 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.423 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.6 p90 -146.04 164.17 32.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.872 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.52 -47.7 8.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.169 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -165.18 161.86 19.67 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.135 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -150.6 138.89 20.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.789 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -147.0 168.52 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.978 0.418 . . . . 0.0 111.288 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.631 HG23 ' HB ' ' A' ' 80' ' ' THR . 8.8 p -119.15 139.33 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 113' ' ' VAL . 38.9 mm -129.69 151.96 36.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.987 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 14.9 m -109.94 -29.28 8.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.244 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -101.42 149.64 23.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.812 0.339 . . . . 0.0 110.872 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -69.44 -21.28 63.74 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.884 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -61.79 -57.74 10.68 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.114 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -75.19 -22.34 58.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.582 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.714 HD22 ' CE3' ' A' ' 81' ' ' TRP . 3.6 tp -80.23 -25.7 39.46 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.737 -0.21 . . . . 0.0 111.066 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -52.77 144.75 13.62 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.288 0.566 . . . . 0.0 111.667 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -53.38 -33.36 53.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.603 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -41.0 85.4 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.91 0.386 . . . . 0.0 110.446 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -71.34 -45.23 63.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.88 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.478 HG22 HD13 ' A' ' 129' ' ' LEU . 42.7 mt -61.32 -49.09 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.954 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -33.52 70.72 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.284 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.6 t -79.23 -43.95 22.78 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -63.07 -45.67 91.06 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.169 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.714 HD21 ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -68.28 -23.81 64.8 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.665 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 20.4 tttm . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.613 0.244 . . . . 0.0 111.11 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 34' ' ' SER . 28.0 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.767 0.318 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 35' ' ' THR . 9.2 mttp -95.13 169.79 9.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.822 HD12 HD12 ' A' ' 36' ' ' ILE . 3.4 tt -129.33 124.87 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.576 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.33 106.11 5.81 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.645 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -39.05 84.65 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.754 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -52.52 64.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.957 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -66.8 -52.96 37.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.293 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.2 m -53.11 -46.96 68.94 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.27 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -65.14 -41.67 94.55 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.716 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.52 75.01 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.665 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.88 99.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.77 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.668 ' HE2' HG13 ' A' ' 105' ' ' VAL . 4.3 t80 -59.25 -42.11 90.35 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.979 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -66.52 -41.46 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.065 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 tp -71.28 -48.27 51.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.639 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.08 -29.51 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.336 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -61.19 -34.15 74.61 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.624 0.249 . . . . 0.0 110.703 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 . . . . . 0 C--O 1.235 0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.381 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.5 t -132.17 98.53 3.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.703 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -104.61 -30.93 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 30.4 p-90 -132.28 157.97 43.02 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.881 0.372 . . . . 0.0 111.582 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -141.63 149.27 20.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.466 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.526 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 90.3 m -88.93 162.47 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.893 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.413 ' N ' HG22 ' A' ' 28' ' ' THR . 9.8 m-85 -148.23 96.41 2.62 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.811 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -123.67 152.56 41.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.452 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -105.56 118.07 35.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.95 0.405 . . . . 0.0 111.054 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.11 90.55 0.87 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.43 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.45 -57.52 4.12 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.491 ' O ' HG23 ' A' ' 3' ' ' THR . 1.7 t -149.66 -35.62 0.17 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 11.3 t -80.28 130.32 35.12 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.924 0.393 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.822 HD12 HD12 ' A' ' 5' ' ' ILE . 33.0 mt -79.29 141.01 15.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.08 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.542 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.5 p -158.59 138.31 8.59 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.049 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 19.4 Cg_endo -59.6 162.61 14.81 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.68 2.253 . . . . 0.0 112.378 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.526 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -131.54 -150.83 6.76 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 121.25 -0.5 . . . . 0.0 112.712 -179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.548 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -38.72 141.44 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.242 0.617 . . . . 0.0 112.47 -179.037 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -139.32 98.83 3.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.142 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.83 165.86 23.76 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.332 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.491 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.1 -21.92 25.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.627 0.251 . . . . 0.0 110.865 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -97.28 128.06 43.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.536 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -73.95 -20.13 60.46 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.652 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.521 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -48.21 -40.74 25.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.828 0.347 . . . . 0.0 110.36 179.46 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -39.38 88.23 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.263 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.569 ' HZ ' ' HB2' ' A' ' 60' ' ' ALA . 6.4 t80 -69.03 -45.22 71.02 Favored 'General case' 0 C--N 1.338 0.066 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.736 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 46' ' ' GLN . 26.7 mt -57.4 -40.54 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.324 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -68.04 -39.53 83.03 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.03 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -89.98 0.03 57.32 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.5 t -110.03 87.4 2.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.88 0.372 . . . . 0.0 111.425 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.33 176.77 5.59 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.448 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.84 19.58 1.68 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -133.07 75.68 1.64 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.714 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.21 -172.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.837 0.351 . . . . 0.0 111.813 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -166.62 96.31 0.55 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.365 179.725 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 pp -151.92 173.31 14.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.443 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -107.06 163.71 12.76 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.134 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HB2' ' HZ ' ' A' ' 48' ' ' PHE . . . -143.11 161.42 38.24 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.022 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -148.05 126.94 12.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -134.99 138.5 48.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.185 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -102.02 106.4 17.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.497 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -108.92 140.0 43.0 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.994 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.4 m . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.928 -179.728 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.233 0.198 0 CA-C-O 120.658 0.266 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -146.54 146.23 30.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.4 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 34.2 m-85 -99.95 130.79 46.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.417 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.596 ' HB2' HD12 ' A' ' 129' ' ' LEU . . . -122.75 127.03 48.65 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.292 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.0 tt -100.94 107.2 18.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.382 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.586 ' CG2' HD12 ' A' ' 114' ' ' ILE . 3.1 mt -99.83 105.03 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.503 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.9 p -88.95 116.53 27.31 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.847 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.418 ' HZ3' HG22 ' A' ' 114' ' ' ILE . 74.9 t-105 -100.25 140.57 34.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.078 0.465 . . . . 0.0 111.82 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 mt -144.57 101.2 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.653 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.33 124.52 9.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.261 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -33.07 -46.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.722 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.0 m-80 -56.05 -10.92 0.92 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -51.98 125.68 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.998 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.09 162.84 28.58 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.64 -50.7 52.61 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.813 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.29 -39.51 87.16 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.772 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.481 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 71.6 mm-40 -61.95 -44.58 96.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -57.06 -48.12 79.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.743 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.41 -44.72 89.16 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.647 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -56.58 -54.58 44.28 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.291 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -48.74 -40.17 27.61 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.489 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.26 -52.37 53.0 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.963 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.719 ' O ' HG22 ' A' ' 99' ' ' THR . 0.6 OUTLIER -62.5 -37.48 86.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.305 . . . . 0.0 110.786 179.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.481 ' O ' HG23 ' A' ' 101' ' ' VAL . 22.6 m-20 -70.06 -35.7 74.42 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.195 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -31.79 71.94 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.299 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 96' ' ' THR . 7.0 t -81.02 -33.33 33.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.951 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.449 ' O ' HG23 ' A' ' 104' ' ' VAL . 36.0 mt -64.22 -43.81 93.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 97' ' ' ASP . 39.6 t -68.02 -42.53 85.38 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -37.41 76.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.0 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.12 -42.51 93.87 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.761 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 100' ' ' LEU . 43.4 t -69.58 -41.34 80.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.909 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.668 HG13 ' HE2' ' A' ' 14' ' ' TYR . 36.3 t -114.1 97.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.949 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -96.18 -22.24 17.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.567 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.6 80.44 5.98 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.965 0.412 . . . . 0.0 110.514 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -129.27 172.91 11.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.734 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -117.34 -53.95 2.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.531 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.1 125.57 13.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.776 0.322 . . . . 0.0 111.494 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.43 128.35 47.95 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.557 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.408 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 4.4 p90 -144.1 161.75 38.01 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.987 0.422 . . . . 0.0 111.514 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.6 t -100.81 141.99 16.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.392 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.586 HD12 ' CG2' ' A' ' 79' ' ' ILE . 31.7 mt -135.94 135.78 50.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 21.3 t -118.58 -15.98 9.51 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.991 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -115.0 151.89 33.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 111.03 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -21.96 66.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.354 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -55.8 22.11 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.576 0.227 . . . . 0.0 110.792 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.475 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 0.6 OUTLIER -73.88 -30.03 62.4 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.542 ' N ' HG21 ' A' ' 114' ' ' ILE . 0.9 OUTLIER -68.72 -25.85 64.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.689 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.04 136.98 56.32 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -53.21 -29.94 34.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.924 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -59.91 -47.16 86.92 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.945 0.402 . . . . 0.0 110.425 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.475 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 30.8 t80 -68.21 -48.36 65.42 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.862 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.408 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 59.6 mt -54.61 -43.74 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -43.29 80.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.179 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -47.54 76.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.819 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.63 -42.83 97.7 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.118 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.596 HD12 ' HB2' ' A' ' 77' ' ' ALA . 5.2 tt -70.23 -31.97 69.63 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.249 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.53 0.191 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.738 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 t . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 120.718 0.294 . . . . 0.0 110.638 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' O ' ' HA ' ' A' ' 35' ' ' THR . 12.2 mttp -99.51 151.42 21.17 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.065 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.511 HG13 ' HB ' ' A' ' 36' ' ' ILE . 3.8 tt -116.71 128.96 73.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.37 106.67 16.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -58.57 -37.34 75.54 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.215 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.27 -49.81 76.41 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.912 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.86 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.56 -53.89 44.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.307 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' HG11 ' A' ' 104' ' ' VAL . 1.7 t -53.54 -43.04 68.09 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.187 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -68.78 -43.07 76.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.64 -45.97 73.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.697 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -64.52 -48.39 75.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.84 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -53.39 -46.57 69.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.855 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -57.52 -43.52 84.36 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.019 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.28 -40.84 81.72 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.077 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 13' ' ' ALA . 42.8 t -64.69 -42.01 93.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.842 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.6 -41.27 80.9 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.631 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.233 0.234 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.641 179.528 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 N--CA 1.465 0.315 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 41' ' ' GLN . 42.9 t -124.89 114.31 39.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 111.22 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.466 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -107.41 -30.16 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.434 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -131.27 154.87 48.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.878 0.371 . . . . 0.0 111.173 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.514 ' CG1' HG22 ' A' ' 17' ' ' VAL . 34.2 m -142.17 146.77 22.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.261 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.22 170.71 9.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.995 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -148.56 98.96 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.36 179.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.26 -179.57 3.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.013 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 35.2 p90 -140.8 128.56 21.67 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.023 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.44 ' O ' HG22 ' A' ' 35' ' ' THR . 1.1 t70 -96.9 107.16 19.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.397 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.59 -77.56 1.07 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.161 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.72 38.31 0.47 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.753 0.311 . . . . 0.0 111.359 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.44 HG22 ' O ' ' A' ' 32' ' ' ASP . 2.6 t -140.77 122.73 15.52 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.898 0.38 . . . . 0.0 110.987 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.511 ' HB ' HG13 ' A' ' 5' ' ' ILE . 4.0 mm -79.47 133.44 29.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.94 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.564 HG23 ' HB1' ' A' ' 9' ' ' ALA . 9.8 p -157.09 139.0 10.11 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.005 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.86 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 15.6 Cg_endo -56.34 162.75 7.39 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.61 2.207 . . . . 0.0 112.329 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -127.06 -157.96 9.66 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.387 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.5 mp0 -32.63 139.11 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.782 0.833 . . . . 0.0 112.611 -179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.464 ' HB3' HG11 ' A' ' 24' ' ' VAL . 22.3 mt-30 -136.4 91.78 2.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.408 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.18 168.5 21.44 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 113.317 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.466 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -94.21 -15.23 24.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.754 -0.223 . . . . 0.0 111.187 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -96.72 129.61 44.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -78.42 -17.09 56.88 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.717 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -49.76 -40.57 41.61 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.765 0.317 . . . . 0.0 110.601 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.91 -36.17 81.65 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.928 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.525 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 8.1 t80 -60.7 -46.7 89.38 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.761 0.315 . . . . 0.0 110.788 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 25.1 mt -63.94 -41.47 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -70.42 -40.05 74.07 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.715 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.16 -42.01 69.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.535 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -73.71 81.91 1.57 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.921 0.391 . . . . 0.0 111.265 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 p -117.4 155.83 28.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.56 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.479 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 7.2 m-20 -72.33 69.53 0.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.203 0.525 . . . . 0.0 110.95 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.734 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.5 t70 -170.03 46.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.098 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.668 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.66 -171.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.885 0.374 . . . . 0.0 111.935 -178.457 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.755 ' HB3' HG12 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -160.99 94.51 1.02 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.565 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 177.11 11.58 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.849 0.357 . . . . 0.0 111.675 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.741 ' CD2' HG23 ' A' ' 80' ' ' THR . 28.7 m-85 -109.74 163.43 13.51 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.462 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.525 ' HB1' ' CE2' ' A' ' 48' ' ' PHE . . . -147.42 141.48 26.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.084 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.537 ' HE1' HD12 ' A' ' 78' ' ' LEU . 1.5 t80 -122.39 135.42 54.69 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.021 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -137.24 136.17 47.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.179 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -101.76 127.1 48.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.826 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -107.56 151.22 25.89 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.184 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.155 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.658 0.266 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -137.9 144.03 41.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.891 0.377 . . . . 0.0 111.402 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.563 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 3.6 m-85 -94.0 134.99 35.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.795 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -135.95 106.27 6.41 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.892 0.377 . . . . 0.0 111.429 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.537 HD12 ' HE1' ' A' ' 61' ' ' PHE . 7.7 tt -96.35 117.05 30.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.41 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.413 HG21 ' CD2' ' A' ' 120' ' ' LEU . 2.1 mp -118.87 119.94 62.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 120.878 0.37 . . . . 0.0 111.345 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.741 HG23 ' CD2' ' A' ' 59' ' ' PHE . 1.5 m -88.08 138.58 31.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.235 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.668 ' CE3' HD12 ' A' ' 120' ' ' LEU . 52.5 t-105 -115.54 125.98 53.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.912 0.387 . . . . 0.0 111.192 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.668 HG13 HG11 ' A' ' 86' ' ' VAL . 3.3 tt -123.59 81.4 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.523 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.546 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -62.48 126.05 36.89 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.572 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -29.62 -34.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.734 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.7 m-80 -73.93 39.64 0.11 Allowed 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.755 HG12 ' HB3' ' A' ' 57' ' ' ARG . 4.7 m -96.46 112.08 27.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.505 178.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.9 170.15 16.8 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.154 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -46.03 -50.65 12.04 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.493 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.67 -35.94 81.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.625 0.212 . . . . 0.0 111.513 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.465 ' HG3' ' HG3' ' A' ' 57' ' ' ARG . 3.0 mp0 -65.09 -39.93 93.87 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.997 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -50.68 -50.42 54.88 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.837 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.22 -38.58 68.96 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -55.33 -40.68 71.48 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.366 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.5 m -53.26 -46.91 69.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.151 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.06 -50.4 65.78 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.001 -0.618 . . . . 0.0 112.624 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.5 p -62.66 -41.22 98.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.562 0.22 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -66.64 -40.87 88.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.09 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -30.21 68.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.772 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.5 m -71.9 -42.68 66.46 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.774 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -56.52 -56.07 25.88 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.19 -36.55 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.963 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -45.1 89.94 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.907 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.07 -38.05 84.86 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.554 HG11 ' SG ' ' A' ' 10' ' ' CYS . 20.3 t -73.74 -43.54 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.35 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.89 100.25 10.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.926 0.393 . . . . 0.0 111.118 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -103.47 -29.34 11.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.573 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.78 83.81 4.9 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.14 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -138.19 -179.14 5.61 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.736 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -109.6 -67.19 1.0 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.387 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -134.87 144.57 47.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.41 137.05 43.74 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.582 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 8.7 p90 -155.66 173.98 15.95 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.101 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.535 HG23 ' HB ' ' A' ' 80' ' ' THR . 9.9 p -124.41 141.01 45.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.404 HD12 ' HB3' ' A' ' 119' ' ' GLU . 30.8 mm -126.22 153.37 34.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.15 -179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 m -117.59 -24.74 7.16 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -117.81 146.81 43.58 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.941 0.4 . . . . 0.0 111.168 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -62.57 -28.04 69.6 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.594 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.87 -45.76 91.47 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.667 0.27 . . . . 0.0 110.886 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.404 ' HB3' HD12 ' A' ' 114' ' ' ILE . 1.8 mt-10 -77.55 -31.5 53.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.8 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.841 HD23 HD11 ' A' ' 125' ' ' ILE . 0.4 OUTLIER -79.76 -2.23 42.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.732 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.07 132.23 53.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.931 0.396 . . . . 0.0 110.523 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.39 -37.76 49.93 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.609 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.5 -43.1 99.46 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.28 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -67.94 -51.54 46.43 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.834 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.841 HD11 HD23 ' A' ' 120' ' ' LEU . 63.7 mt -57.71 -50.44 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -55.05 -42.09 72.27 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.185 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -40.69 94.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.045 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -63.14 -56.8 13.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.577 HD23 HG22 ' A' ' 125' ' ' ILE . 2.8 pp -63.81 -23.54 67.4 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.609 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.8 tttt . . . . . 0 CA--C 1.53 0.197 0 CA-C-O 120.421 0.153 . . . . 0.0 110.911 179.431 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 t . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.837 0.351 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -179.55 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.565 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.567 ' HB ' HD12 ' A' ' 36' ' ' ILE . 2.5 tt -130.72 133.32 63.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.747 0.308 . . . . 0.0 111.16 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -83.13 96.17 8.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.37 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -59.83 -42.92 94.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.244 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.98 -49.81 74.62 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.323 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.429 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -70.27 -50.94 34.49 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 40.8 m -55.35 -42.9 74.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -66.11 -47.23 74.85 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.516 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.28 -44.19 71.68 Favored 'General case' 0 CA--C 1.527 0.06 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.894 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.528 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -66.62 -37.48 84.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.252 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -55.13 -60.07 3.89 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.15 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -63.96 -29.48 70.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.526 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.947 HD23 HG11 ' A' ' 24' ' ' VAL . 4.0 tt -62.55 -44.54 96.07 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.714 0.293 . . . . 0.0 110.603 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 13' ' ' ALA . 52.3 t -68.2 -34.63 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.58 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -60.3 -35.99 76.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.412 179.335 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.947 HG11 HD23 ' A' ' 16' ' ' LEU . 14.2 p -118.34 117.77 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.519 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.684 HD12 HG13 ' A' ' 62' ' ' VAL . 1.1 pt -121.57 -31.56 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.538 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 32.2 p-90 -130.87 158.42 40.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.951 0.405 . . . . 0.0 111.384 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.769 HG12 ' HG2' ' A' ' 41' ' ' GLN . 14.5 m -144.52 145.18 21.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.23 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.495 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 16.7 p -105.7 100.23 9.8 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.812 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' A' ' 59' ' ' PHE . 3.8 m-85 -78.89 109.62 13.34 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.666 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -128.45 135.58 49.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.593 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -91.69 123.7 35.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.98 123.33 45.69 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.715 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.1 -83.04 0.74 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.357 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.94 31.06 0.56 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.5 t -149.82 139.22 21.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.744 0.307 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.567 HD12 ' HB ' ' A' ' 5' ' ' ILE . 7.0 mt -85.09 137.77 20.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.901 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.415 HG23 ' CB ' ' A' ' 9' ' ' ALA . 10.0 p -155.15 141.26 12.96 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.499 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.439 ' HG3' ' CZ ' ' A' ' 29' ' ' PHE . 37.8 Cg_exo -57.56 154.34 36.92 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.555 2.17 . . . . 0.0 112.515 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -128.45 -155.74 8.75 Favored Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 121.325 -0.464 . . . . 0.0 112.082 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.5 mp0 -24.52 130.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.727 0.811 . . . . 0.0 112.643 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.769 ' HG2' HG12 ' A' ' 27' ' ' VAL . 13.9 mt-30 -131.69 98.13 4.4 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.32 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.85 164.33 24.98 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.482 -0.866 . . . . 0.0 113.32 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.596 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -89.67 -20.66 23.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.62 0.248 . . . . 0.0 110.889 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.81 126.49 37.91 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.795 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 12.9 t80 -70.79 -19.13 62.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.671 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -46.98 -41.94 17.12 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.745 0.307 . . . . 0.0 110.643 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.89 -36.68 82.83 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.937 178.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -58.68 -49.34 77.93 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.099 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.3 mt -70.85 -42.61 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.67 -45.43 94.16 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.027 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -76.39 -31.01 57.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.8 m -75.29 84.55 2.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.056 0.455 . . . . 0.0 111.5 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p -93.17 169.67 10.22 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.15 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -85.46 17.43 3.19 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.721 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -133.67 67.86 1.51 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.296 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.721 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -177.35 -172.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.386 -179.096 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.746 ' HD3' HG12 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -159.06 114.91 2.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.778 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 pp -158.31 154.06 26.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.827 0.346 . . . . 0.0 111.537 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 1.5 m-85 -107.05 98.98 8.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.407 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -107.92 157.41 18.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.767 ' HB3' HD23 ' A' ' 78' ' ' LEU . 31.7 p90 -152.37 164.29 37.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.262 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.684 HG13 HD12 ' A' ' 25' ' ' ILE . 4.4 t -137.41 152.54 27.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.364 -179.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -113.26 104.11 12.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.633 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -103.7 173.33 6.35 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.22 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.274 179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.761 0.315 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.426 ' HD3' ' HB1' ' A' ' 109' ' ' ALA . 24.5 mttm -151.73 146.33 25.68 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.953 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.595 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 76.1 m-85 -92.98 170.68 9.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.116 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.666 ' HB2' ' CD1' ' A' ' 129' ' ' LEU . . . -154.87 105.54 2.58 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.767 HD23 ' HB3' ' A' ' 61' ' ' PHE . 7.4 mt -80.99 134.64 35.73 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.203 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.514 ' CG2' HD12 ' A' ' 114' ' ' ILE . 21.4 mt -129.8 105.43 12.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.027 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.864 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.3 OUTLIER -80.23 97.04 6.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.208 179.601 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.41 ' CZ3' HD12 ' A' ' 120' ' ' LEU . 71.2 t-105 -89.22 135.03 33.79 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 41.4 mt -141.58 101.4 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.78 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.68 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -68.08 117.06 8.17 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.026 -0.606 . . . . 0.0 112.221 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.435 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.2 mt-10 -32.04 -40.3 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -179.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.709 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.0 m-80 -71.28 42.0 0.07 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 111.942 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.746 HG12 ' HD3' ' A' ' 57' ' ' ARG . 2.7 m -95.49 135.2 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.491 178.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.16 164.49 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.47 83.47 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.024 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 tp -66.46 -32.14 73.32 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.622 0.211 . . . . 0.0 111.317 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -59.25 -40.21 85.25 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.959 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -40.45 80.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.18 -39.36 40.99 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -58.45 -46.32 86.79 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.011 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -42.28 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.193 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.43 -46.65 93.57 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.191 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.1 -43.13 68.32 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.646 0.26 . . . . 0.0 110.837 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.646 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.7 m-20 -61.6 -38.79 88.88 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.422 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.73 -30.62 70.09 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.681 0.277 . . . . 0.0 110.664 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 23.3 m -71.54 -41.82 68.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.412 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 97' ' ' ASP . 8.7 mt -63.33 -51.24 66.81 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.39 -30.58 49.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.312 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -65.55 -45.12 84.61 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.638 0.256 . . . . 0.0 110.676 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -38.69 81.99 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.831 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 26.2 t -78.26 -37.04 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.971 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -129.8 83.31 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.94 0.4 . . . . 0.0 110.751 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.0 -35.63 7.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.196 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.97 77.83 2.85 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -124.73 179.39 5.0 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -92.17 -59.36 2.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.5 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.85 154.29 51.22 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.751 0.31 . . . . 0.0 111.359 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -148.88 135.6 19.7 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.174 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.662 ' HE2' HD11 ' A' ' 114' ' ' ILE . 13.7 p90 -160.44 159.32 30.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.927 0.394 . . . . 0.0 111.292 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.864 HG12 ' HB ' ' A' ' 80' ' ' THR . 2.6 m -100.3 147.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.992 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.662 HD11 ' HE2' ' A' ' 112' ' ' PHE . 59.6 mt -142.18 140.62 29.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.956 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 54.6 m -140.49 31.57 1.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.413 ' H ' HG22 ' A' ' 114' ' ' ILE . 33.1 t70 -145.8 134.57 22.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.488 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -34.06 74.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.948 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -69.08 -41.09 78.0 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.681 0.277 . . . . 0.0 110.485 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.71 -32.85 64.11 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.666 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.41 HD12 ' CZ3' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -69.12 -24.94 64.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.577 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.91 135.2 12.66 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.045 0.45 . . . . 0.0 111.336 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -50.79 -33.74 24.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.094 -179.538 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -38.34 73.22 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 110.309 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -76.14 -46.2 29.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.714 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.497 HG21 HD11 ' A' ' 79' ' ' ILE . 29.3 mm -60.19 -51.47 72.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.225 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.0 -42.79 95.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.684 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.1 t -62.78 -43.36 99.01 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.571 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.02 -42.44 90.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.092 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.666 ' CD1' ' HB2' ' A' ' 77' ' ' ALA . 2.2 tp -64.42 -43.14 95.29 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.446 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 32.7 tttp . . . . . 0 C--O 1.232 0.142 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.26 -179.807 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -88.62 150.81 22.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.072 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 tt -120.86 124.3 72.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.596 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.08 112.92 9.57 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.911 0.386 . . . . 0.0 110.806 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -72.24 -42.97 65.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.925 -179.834 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -57.06 -51.45 69.22 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.019 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.729 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.15 -50.78 71.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.3 t -57.35 -44.24 84.13 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.211 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -65.78 -42.0 91.31 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.35 -47.91 68.97 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.747 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.17 84.6 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.666 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -59.26 -37.58 77.95 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.124 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -69.98 -44.25 69.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.284 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -46.88 67.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.102 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.92 -24.91 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.39 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -39.84 66.68 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.881 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 C--O 1.234 0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.571 179.655 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.96 0.41 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.547 HG11 ' CD ' ' A' ' 41' ' ' GLN . 40.2 t -142.59 125.0 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.468 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -127.01 -29.28 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.575 ' HB2' HG22 ' A' ' 62' ' ' VAL . 32.7 p-90 -132.96 157.65 44.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.952 0.406 . . . . 0.0 111.727 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.62 HG13 ' HG3' ' A' ' 41' ' ' GLN . 2.3 t -139.07 150.52 23.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.255 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.43 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 73.7 m -90.99 159.97 15.87 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.492 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -145.29 93.16 2.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.208 0.528 . . . . 0.0 110.558 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -113.31 179.14 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -143.78 130.32 20.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.979 0.419 . . . . 0.0 111.427 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.8 -149.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.271 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.4 83.17 0.06 OUTLIER Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.558 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m 65.42 49.62 1.84 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.58 0.352 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.7 t -164.07 113.44 1.21 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.138 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.443 ' O ' HG13 ' A' ' 37' ' ' VAL . 31.2 mt -85.68 139.75 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 36' ' ' ILE . 4.6 m -156.57 154.5 27.04 Favored Pre-proline 0 C--O 1.233 0.185 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.28 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.729 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 44.7 Cg_endo -67.31 166.06 24.73 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.539 2.159 . . . . 0.0 112.255 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.43 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -139.1 -147.02 5.04 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.566 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.7 mp0 -31.96 133.33 0.1 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.356 0.662 . . . . 0.0 112.334 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.62 ' HG3' HG13 ' A' ' 27' ' ' VAL . 1.2 tt0 -136.37 93.97 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.12 168.61 26.02 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.098 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.468 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -86.82 -19.44 28.99 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.573 0.225 . . . . 0.0 110.799 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -89.95 112.14 23.43 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -66.72 -23.1 66.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.768 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.791 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -48.7 -35.04 13.11 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.678 0.275 . . . . 0.0 110.792 179.613 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 -38.78 90.81 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.052 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.583 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 56.9 t80 -70.97 -38.9 72.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.576 0.227 . . . . 0.0 110.926 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.791 HD12 ' HA ' ' A' ' 46' ' ' GLN . 17.0 mt -62.93 -40.28 88.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.795 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -45.9 85.21 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.359 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -31.63 67.89 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.468 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.443 ' HB3' ' CD1' ' A' ' 120' ' ' LEU . 1.8 m -74.01 83.94 1.76 Allowed 'General case' 0 C--O 1.233 0.184 0 CA-C-O 120.971 0.415 . . . . 0.0 111.182 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.2 p -100.29 -176.97 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.075 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.25 18.08 2.31 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.853 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.638 ' O ' HG13 ' A' ' 56' ' ' VAL . 47.9 t0 -144.09 79.59 1.62 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.854 0.359 . . . . 0.0 110.219 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.638 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.59 -175.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.39 -179.417 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.718 ' HD2' HG23 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -171.57 77.2 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.073 0.463 . . . . 0.0 110.671 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -132.38 170.95 14.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.463 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -106.2 174.88 5.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.583 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -151.48 157.76 42.74 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.255 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.402 ' CD2' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -135.3 121.09 19.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.799 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.575 HG22 ' HB2' ' A' ' 26' ' ' TRP . 16.2 t -135.77 127.24 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.102 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.16 118.45 26.58 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.471 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -106.3 154.14 21.18 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.863 0.364 . . . . 0.0 111.662 -179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.232 0.179 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.324 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.742 0.306 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.503 ' HE3' HD23 ' A' ' 129' ' ' LEU . 0.0 OUTLIER -143.19 150.71 39.74 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.098 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.42 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 11.6 m-85 -105.55 116.97 32.84 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.002 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.09 123.62 50.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.822 0.344 . . . . 0.0 111.428 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.442 ' HB3' ' CB ' ' A' ' 111' ' ' GLU . 3.5 tp -98.18 104.65 16.7 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.337 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.464 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 38.6 mm -85.68 100.06 8.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 86.5 m -84.8 108.77 17.64 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.31 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.661 ' CE3' HD11 ' A' ' 120' ' ' LEU . 66.5 t-105 -95.29 138.78 32.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.967 0.413 . . . . 0.0 111.435 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.508 HG23 ' OG ' ' A' ' 115' ' ' SER . 2.7 tt -141.1 88.02 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.831 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.46 123.37 33.13 Favored Glycine 0 C--N 1.336 0.563 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.57 -39.83 0.52 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -178.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.9 m-80 -73.75 42.96 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.226 0.536 . . . . 0.0 111.549 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.718 HG23 ' HD2' ' A' ' 57' ' ' ARG . 8.1 p -96.59 135.61 30.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.766 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 m -71.33 157.87 37.34 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.89 -42.83 87.11 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.987 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mt -58.85 -43.11 90.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.638 0.256 . . . . 0.0 111.045 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.92 -33.78 76.34 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.194 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -52.74 33.57 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.975 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.47 -36.44 78.97 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 179.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -43.28 69.82 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -49.19 -46.83 46.11 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.16 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.62 -45.85 93.61 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.373 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 21.8 m -62.54 -46.57 87.79 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.71 0.29 . . . . 0.0 110.877 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.573 ' HA ' HD12 ' A' ' 100' ' ' LEU . 62.8 m-20 -61.03 -37.29 82.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -57.19 -34.09 68.15 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.709 0.29 . . . . 0.0 110.637 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.7 m -72.66 -43.39 63.23 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.624 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 97' ' ' ASP . 37.9 mt -58.31 -47.13 84.66 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 38.8 t -64.64 -38.28 82.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.873 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -38.18 90.14 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.97 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -63.74 -38.93 92.96 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.758 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 t -81.59 -42.86 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.046 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -108.75 102.72 14.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.904 0.383 . . . . 0.0 110.984 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mp0 -100.93 -28.86 12.53 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.339 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -80.57 78.7 7.28 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.006 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.42 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 26.1 p90 -133.88 160.47 37.57 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.6 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -97.94 -61.89 1.32 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.437 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.87 149.54 33.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.442 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -144.93 129.46 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.673 ' HE1' HD11 ' A' ' 114' ' ' ILE . 10.4 p90 -144.02 161.78 37.89 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.97 0.414 . . . . 0.0 111.261 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.485 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 14.5 p -101.18 140.79 19.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.034 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.673 HD11 ' HE1' ' A' ' 112' ' ' PHE . 15.9 mt -133.63 148.39 30.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.508 ' OG ' HG23 ' A' ' 82' ' ' ILE . 1.7 m -131.16 26.42 4.87 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.228 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.606 ' H ' HG22 ' A' ' 114' ' ' ILE . 24.4 t70 -134.19 138.14 44.92 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.606 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -37.06 80.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.006 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -43.27 99.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -69.61 -31.56 69.75 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.613 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.661 HD11 ' CE3' ' A' ' 81' ' ' TRP . 17.1 mt -62.25 -31.96 72.59 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.969 179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -46.17 127.62 8.83 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -49.8 -41.65 45.06 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.647 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -56.2 -42.7 77.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.96 0.409 . . . . 0.0 110.278 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -64.51 -48.82 73.72 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 31.6 mt -59.26 -45.58 92.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -44.02 72.85 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.861 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.9 t -63.07 -43.16 99.37 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.744 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -52.23 65.5 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.503 HD23 ' HE3' ' A' ' 75' ' ' LYS . 2.4 mp -61.12 -31.88 71.58 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.717 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.954 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.755 0.312 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -129.39 170.13 14.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.151 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -124.48 129.38 73.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.683 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.436 ' HB2' HG12 ' A' ' 37' ' ' VAL . 4.7 m-20 -81.26 112.57 18.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.599 ' HE3' HG22 ' A' ' 104' ' ' VAL . 6.2 mptt -68.55 -40.98 80.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.753 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.52 -47.07 76.84 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.032 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.646 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -68.49 -54.15 18.73 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.266 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 m -52.86 -47.88 67.47 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.433 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -67.46 -38.62 84.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.07 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.34 -50.31 71.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.021 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.642 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.33 -45.52 93.13 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.925 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -55.66 -44.51 77.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -57.44 -42.9 83.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.911 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -39.39 93.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.944 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 13' ' ' ALA . 17.7 t -64.56 -35.15 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.129 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -38.03 63.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.048 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.544 179.486 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.553 ' C ' ' HB2' ' A' ' 43' ' ' ALA . . . . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.977 0.417 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.89 107.07 5.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.948 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 HG23 ' A' ' 62' ' ' VAL . 1.1 pp -112.69 -29.58 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.742 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.419 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.8 p-90 -127.31 160.22 32.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.998 0.427 . . . . 0.0 111.391 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.905 HG13 ' HG2' ' A' ' 41' ' ' GLN . 2.6 t -139.42 149.77 22.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.469 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 60.5 m -89.01 161.92 16.32 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.401 ' N ' HG22 ' A' ' 28' ' ' THR . 15.8 m-85 -149.0 93.45 2.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.676 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 ptmm? -132.38 142.74 49.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -85.57 133.34 34.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.058 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.24 110.14 22.23 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.184 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.87 -71.08 2.79 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.932 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.4 p -162.36 30.52 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.585 0.231 . . . . 0.0 111.204 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 37.4 p -144.33 123.95 13.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.783 0.325 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.3 mp -72.73 130.08 35.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.85 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.436 HG12 ' HB2' ' A' ' 6' ' ' ASP . 10.6 m -151.78 145.7 18.01 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.35 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.646 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 29.2 Cg_exo -62.09 168.35 9.28 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.568 2.179 . . . . 0.0 112.46 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.469 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -140.33 -145.9 4.73 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.598 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.6 mp0 -34.22 137.92 0.1 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.353 0.661 . . . . 0.0 112.582 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.905 ' HG2' HG13 ' A' ' 27' ' ' VAL . 4.9 mt-30 -134.76 96.82 3.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.002 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.13 163.13 25.1 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.437 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.553 ' HB2' ' C ' ' A' ' 23' ' ' ALA . . . -86.4 -22.37 26.62 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.719 -0.241 . . . . 0.0 110.927 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -94.8 113.38 25.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.129 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -64.36 -20.1 65.9 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.627 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.8 OUTLIER -46.46 -38.59 9.37 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.704 0.287 . . . . 0.0 110.746 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -42.01 97.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.208 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.475 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 24.3 t80 -69.07 -39.46 79.09 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.685 0.278 . . . . 0.0 110.713 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.627 HD12 ' HA ' ' A' ' 46' ' ' GLN . 25.7 mt -63.63 -34.93 70.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.067 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.29 -25.02 25.71 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.625 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -25.41 26.33 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.596 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.6 p -75.07 66.76 1.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.892 0.377 . . . . 0.0 111.513 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -72.73 149.72 43.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.914 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.419 ' HB2' ' HB2' ' A' ' 84' ' ' GLU . 5.5 p-10 -80.56 56.06 2.5 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.453 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.699 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.0 OUTLIER -161.31 39.74 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.901 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.699 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.97 152.89 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.304 -179.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.476 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -112.6 129.71 56.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.407 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 pp -160.47 175.1 13.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.037 0.446 . . . . 0.0 111.782 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.494 ' CD1' HG23 ' A' ' 80' ' ' THR . 34.4 m-85 -111.3 178.83 4.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.924 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.734 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -145.6 159.88 42.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.033 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -149.02 118.66 6.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.835 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.457 HG23 HD12 ' A' ' 25' ' ' ILE . 14.4 p -149.97 139.4 15.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.791 0.329 . . . . 0.0 111.206 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.514 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 5.1 ptm180 -120.94 152.61 38.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.404 ' HD2' HD13 ' A' ' 129' ' ' LEU . 55.0 m-85 -139.19 150.8 45.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.055 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.0 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.651 179.497 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.639 0.257 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmpp? -135.7 160.65 37.86 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.308 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.514 ' CD2' ' HB3' ' A' ' 63' ' ' ARG . 81.8 m-85 -112.02 163.12 14.63 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.1 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.551 ' HB2' HD12 ' A' ' 129' ' ' LEU . . . -150.92 126.58 10.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.354 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 4.6 mp -100.14 112.92 25.24 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.322 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.734 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 16.4 mt -104.11 139.6 24.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.387 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.494 HG23 ' CD1' ' A' ' 59' ' ' PHE . 15.2 m -109.23 125.86 52.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.296 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -110.11 141.79 42.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.962 0.41 . . . . 0.0 111.562 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.455 HG23 HG21 ' A' ' 86' ' ' VAL . 72.4 mt -139.59 101.88 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.888 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -75.03 90.45 0.79 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 113.832 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HB2' ' HB2' ' A' ' 54' ' ' ASP . 0.5 OUTLIER 19.09 -73.15 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 178.369 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.604 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 21.1 m-80 -41.58 -26.46 0.07 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.072 0.549 . . . . 0.0 112.183 -178.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 83' ' ' GLY . 16.6 t -44.62 104.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 m -69.16 173.52 5.53 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.01 0.433 . . . . 0.0 111.909 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.97 -45.32 93.88 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.554 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -41.68 71.25 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.854 0.359 . . . . 0.0 110.65 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.476 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.8 mp0 -65.85 -36.34 83.19 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.542 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -46.8 81.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.485 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.35 98.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.504 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -59.06 -38.6 79.76 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.59 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 28.6 m -63.89 -39.47 94.27 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.719 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -60.89 -46.21 94.99 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.331 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -40.99 98.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.601 0.239 . . . . 0.0 110.649 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' HG23 ' A' ' 101' ' ' VAL . 73.2 m-20 -65.91 -38.0 87.55 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.889 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -56.86 -33.67 67.05 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.783 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.5 m -74.83 -41.39 59.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.432 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.545 ' O ' HG23 ' A' ' 104' ' ' VAL . 25.3 mt -61.76 -46.06 91.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.016 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 97' ' ' ASP . 23.3 t -66.14 -40.87 88.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.769 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -57.2 -42.38 81.15 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -65.32 -41.13 94.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.718 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.599 HG22 ' HE3' ' A' ' 7' ' ' LYS . 38.2 t -70.44 -48.86 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.977 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -113.21 107.27 22.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.891 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -107.77 -22.44 12.47 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.853 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -75.69 79.43 2.65 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.827 0.346 . . . . 0.0 111.379 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.417 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 29.0 p90 -143.37 159.7 41.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.723 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -87.48 -58.86 2.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.162 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.6 pttp -150.18 172.63 15.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.275 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 10.3 pt-20 -153.93 150.44 28.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.226 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.509 ' HE1' HD11 ' A' ' 114' ' ' ILE . 8.8 p90 -160.18 165.99 30.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.229 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.4 p -108.39 145.34 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.251 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.568 HG22 ' H ' ' A' ' 116' ' ' ASP . 40.9 mt -135.17 146.46 30.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.692 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.7 p -138.4 29.03 2.45 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.297 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.568 ' H ' HG22 ' A' ' 114' ' ' ILE . 22.3 t70 -144.0 135.25 25.66 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.663 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -38.39 81.62 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -65.53 -46.76 78.31 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.703 0.287 . . . . 0.0 110.758 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -69.37 -30.33 68.3 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.476 ' HA ' HD23 ' A' ' 120' ' ' LEU . 0.8 OUTLIER -71.76 -23.09 61.53 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.411 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -48.22 138.44 9.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.169 0.509 . . . . 0.0 111.795 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -36.69 34.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.054 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.57 -39.76 71.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.488 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -71.25 -46.3 61.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.087 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mt -61.94 -47.9 91.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.191 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -38.33 90.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.246 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.7 t -67.54 -43.48 80.63 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.554 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -64.52 -45.13 88.56 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.106 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' A' ' 77' ' ' ALA . 0.9 OUTLIER -62.18 -34.1 75.78 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.33 179.906 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.53 0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.387 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.92 0.39 . . . . 0.0 110.778 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -111.24 176.87 4.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.821 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tt -134.22 128.47 52.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.027 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -81.5 94.73 6.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 1.4 mttm -60.99 -45.31 95.3 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.268 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -54.39 -44.99 72.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.094 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.522 ' HB1' HG23 ' A' ' 37' ' ' VAL . . . -73.15 -50.47 22.49 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.365 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 m -56.11 -43.69 78.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.28 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -69.68 -46.47 65.99 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.44 -43.83 62.15 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.69 0.281 . . . . 0.0 111.155 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -73.35 -36.4 66.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.605 ' CE1' HG13 ' A' ' 105' ' ' VAL . 12.5 t80 -58.82 -55.86 29.63 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.897 -179.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -67.53 -31.66 71.91 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.84 -49.77 55.59 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.654 0.264 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.716 HG21 HG11 ' A' ' 27' ' ' VAL . 44.6 t -69.0 -23.79 27.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -52.5 -36.74 55.88 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.9 t70 . . . . . 0 C--O 1.233 0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.285 179.273 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.298 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 24' ' ' VAL . 11.2 p -125.71 118.21 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.875 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -119.63 -33.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.475 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.7 p-90 -131.77 157.68 43.19 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.963 0.411 . . . . 0.0 111.041 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.716 HG11 HG21 ' A' ' 17' ' ' VAL . 17.4 m -145.83 151.99 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.52 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.533 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 40.1 m -90.5 162.06 15.22 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.709 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -146.61 91.22 2.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.173 0.511 . . . . 0.0 110.461 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.91 165.54 14.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.912 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.568 ' HB3' HD13 ' A' ' 36' ' ' ILE . 48.8 p90 -103.13 123.18 46.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.06 0.457 . . . . 0.0 111.279 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.33 114.8 24.82 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.12 38.62 59.28 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.094 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.5 p 69.28 22.39 6.67 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.708 0.403 . . . . 0.0 111.758 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.7 p -136.58 130.46 32.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 0.0 111.24 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.568 HD13 ' HB3' ' A' ' 31' ' ' TYR . 23.4 mm -68.93 130.26 33.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.983 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.522 HG23 ' HB1' ' A' ' 9' ' ' ALA . 5.4 p -150.87 138.77 12.4 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.916 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.51 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 49.3 Cg_exo -55.98 162.47 7.1 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.493 2.129 . . . . 0.0 112.579 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.533 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -133.05 -149.29 6.12 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.596 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.49 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.2 mp0 -37.08 137.51 0.34 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.322 0.649 . . . . 0.0 112.605 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' CG ' HG12 ' A' ' 27' ' ' VAL . 30.9 mt-30 -136.91 103.03 5.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.169 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.27 164.52 26.9 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.268 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -82.23 -22.64 35.76 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.675 0.274 . . . . 0.0 110.844 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -94.92 110.51 22.39 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -66.86 -19.07 65.67 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.67 -37.76 29.96 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.687 0.28 . . . . 0.0 110.674 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -36.42 83.93 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.483 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.492 ' CE1' ' HB2' ' A' ' 60' ' ' ALA . 61.4 t80 -67.47 -52.13 42.98 Favored 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.842 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.7 mt -59.09 -35.08 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.188 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.3 -47.03 74.92 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.315 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.73 -42.62 50.12 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.374 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.745 ' SG ' HD11 ' A' ' 58' ' ' LEU . 4.5 m -77.02 80.55 3.55 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 111.15 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.4 p -108.82 173.09 6.47 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.77 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.612 ' HB3' ' HB2' ' A' ' 84' ' ' GLU . 12.4 m-20 -75.2 69.05 2.02 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.029 0.442 . . . . 0.0 111.284 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.679 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.3 t70 -178.55 47.7 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.329 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.679 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -177.26 -175.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.914 -179.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.48 113.08 3.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.698 0.285 . . . . 0.0 111.224 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.745 HD11 ' SG ' ' A' ' 52' ' ' CYS . 3.4 pp -160.61 170.91 19.89 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.9 0.381 . . . . 0.0 111.637 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -105.65 179.36 4.29 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.722 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -160.0 172.64 17.17 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.814 0.34 . . . . 0.0 111.576 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.488 ' CE2' HG11 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -148.33 133.91 18.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.183 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.442 HG22 ' HB2' ' A' ' 26' ' ' TRP . 15.6 t -143.74 133.25 20.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.21 112.43 25.1 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.485 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -98.26 146.94 25.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.952 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.1 m . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.763 179.695 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.8 t . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.868 0.366 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.05 129.64 16.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.805 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.442 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 13.2 m-85 -85.5 126.7 34.04 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.595 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.21 129.33 39.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.479 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.435 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -96.44 141.84 29.25 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.218 179.556 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.629 HG23 HD12 ' A' ' 114' ' ' ILE . 27.2 mt -125.35 122.16 62.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.128 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.513 ' HB ' HG12 ' A' ' 113' ' ' VAL . 7.3 m -104.92 105.9 16.15 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.11 179.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -88.98 121.93 31.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.93 0.395 . . . . 0.0 111.523 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.659 HD11 HG21 ' A' ' 86' ' ' VAL . 4.2 tt -111.38 100.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.706 178.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.506 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -67.97 83.8 0.17 Allowed Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.825 -0.625 . . . . 0.0 114.109 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.612 ' HB2' ' HB3' ' A' ' 54' ' ' ASP . 2.3 mm-40 19.6 -81.34 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 178.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.423 ' OD1' ' HA ' ' A' ' 55' ' ' ASP . 5.6 p30 -66.51 30.83 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -177.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.659 HG21 HD11 ' A' ' 82' ' ' ILE . 3.0 m -64.3 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 161.46 0.5 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.92 -48.63 57.4 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.484 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.55 -33.27 72.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.696 0.284 . . . . 0.0 110.947 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -70.88 -44.78 65.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.314 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -57.69 -47.95 80.92 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.813 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.6 -39.3 93.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.892 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.13 -39.42 86.21 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.063 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -40.8 71.11 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.546 0.212 . . . . 0.0 110.656 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.14 -50.27 57.91 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.595 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -45.84 83.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.87 0.335 . . . . 0.0 110.894 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.532 ' HA ' HD12 ' A' ' 100' ' ' LEU . 74.0 m-20 -60.71 -36.95 80.09 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.262 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -59.44 -33.25 71.04 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.577 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.8 m -68.8 -44.53 73.37 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.454 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 97' ' ' ASP . 12.3 mt -61.77 -45.72 92.67 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 97' ' ' ASP . 38.7 t -65.06 -33.1 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.889 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.71 -32.59 73.99 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.19 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.77 -55.06 10.89 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.823 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.558 HG23 HG23 ' A' ' 105' ' ' VAL . 6.9 m -63.28 -33.89 63.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.614 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.605 HG13 ' CE1' ' A' ' 14' ' ' TYR . 42.1 t -108.82 101.46 12.59 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.496 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -104.3 -33.68 8.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.621 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -78.95 73.19 5.49 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.2 p90 -126.5 156.68 40.35 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.972 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.25 -49.07 4.84 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.277 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.13 141.15 6.73 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.022 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.435 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 14.1 pt-20 -135.44 149.99 49.73 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -159.9 159.84 32.85 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.707 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.513 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.7 m -89.43 153.09 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.979 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.629 HD12 HG23 ' A' ' 79' ' ' ILE . 60.8 mt -136.88 131.48 46.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.886 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -125.57 33.02 5.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.257 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.452 ' H ' HG22 ' A' ' 114' ' ' ILE . 9.7 p-10 -166.86 153.53 8.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.088 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.2 ptt85 -68.58 -24.61 64.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.872 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -63.57 -56.94 12.01 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.67 0.271 . . . . 0.0 110.849 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.467 ' HB2' HG23 ' A' ' 114' ' ' ILE . 37.7 mt-10 -72.17 -24.43 61.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.353 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.57 ' HA ' HD13 ' A' ' 114' ' ' ILE . 2.4 tp -74.33 -25.07 59.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.614 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -52.51 130.76 32.68 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.069 0.461 . . . . 0.0 111.069 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.776 ' HA ' HD12 ' A' ' 125' ' ' ILE . 41.4 tt0 -51.1 -40.6 58.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.899 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.04 -41.74 98.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.897 0.38 . . . . 0.0 110.442 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -63.2 -48.72 77.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.089 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 122' ' ' GLU . 6.9 mt -56.65 -48.07 81.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.007 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.79 -44.98 78.28 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.098 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -39.44 91.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.878 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -59.63 -53.31 59.57 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.018 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.7 pp -69.84 -24.79 63.5 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.744 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? . . . . . 0 N--CA 1.464 0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 111.12 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.737 0.303 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -85.25 145.97 27.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -115.76 125.55 72.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 7.6 t0 -81.97 109.36 16.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.555 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -69.1 -36.89 78.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.97 -47.83 60.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.802 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -56.67 -54.1 50.06 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.888 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.4 m -59.74 -39.0 83.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -60.1 -54.36 46.88 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.44 76.91 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.233 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.75 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -61.9 -49.12 77.48 Favored 'General case' 0 C--N 1.334 -0.072 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.19 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -55.15 -46.28 75.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.507 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 66.6 m-20 -65.49 -26.91 68.13 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.437 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 tp -80.55 -38.54 29.39 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.058 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.75 HG23 ' O ' ' A' ' 13' ' ' ALA . 8.4 t -70.33 -38.31 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.94 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 5.5 ptt180 -61.86 -28.19 69.32 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.15 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.3 t70 . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.588 179.663 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.193 0 CA-C-O 121.017 0.436 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.0 t -133.25 119.77 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.076 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.574 HG12 ' HA ' ' A' ' 43' ' ' ALA . 30.4 pt -120.69 -40.21 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.509 ' CZ3' HG23 ' A' ' 28' ' ' THR . 37.1 p-90 -122.91 158.43 30.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.872 0.367 . . . . 0.0 111.477 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 19.4 m -140.55 143.67 28.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.935 179.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.509 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 3.2 p -102.28 97.29 7.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.994 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 6.0 m-85 -79.45 114.66 18.56 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.938 0.399 . . . . 0.0 110.611 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.16 162.17 34.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.695 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.427 ' HA ' ' O ' ' A' ' 35' ' ' THR . 38.7 p90 -111.04 121.61 45.79 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.039 0.447 . . . . 0.0 111.579 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.16 107.01 18.9 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.103 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.33 -78.71 1.42 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.278 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.4 m -151.65 33.97 0.55 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.601 0.239 . . . . 0.0 111.211 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.427 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 2.6 t -144.7 123.8 12.87 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 7.0 mt -84.88 126.08 40.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.158 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.493 HG12 ' CB ' ' A' ' 9' ' ' ALA . 5.9 m -148.6 156.91 41.88 Favored Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.519 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.802 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.0 Cg_endo -65.71 156.68 62.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.657 2.238 . . . . 0.0 112.295 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.41 -154.42 7.81 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.327 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.556 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.7 mp0 -27.59 132.69 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.681 0.792 . . . . 0.0 112.16 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.487 ' HG2' HG12 ' A' ' 27' ' ' VAL . 20.7 mt-30 -134.18 97.16 3.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.188 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.72 164.95 22.39 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.571 -0.823 . . . . 0.0 113.263 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.33 -17.28 24.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.743 -0.228 . . . . 0.0 111.055 179.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -92.65 129.49 38.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.673 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.506 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 23.8 t80 -77.89 -15.5 58.97 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -48.27 -41.64 28.41 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.721 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.59 -38.27 80.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.733 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.463 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 4.0 t80 -57.99 -45.78 86.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.08 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 47.7 mt -65.51 -46.18 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.995 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.97 -38.62 91.75 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.95 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 -30.93 58.79 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.73 74.57 3.39 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.808 0.337 . . . . 0.0 111.565 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -100.52 144.38 29.58 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.645 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.541 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.2 p-10 -76.05 64.96 2.0 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 111.642 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.756 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.7 t0 -168.44 44.71 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.97 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.66 -176.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.516 HH11 HG23 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -140.21 112.86 8.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.447 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.89 139.54 26.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.946 0.403 . . . . 0.0 111.466 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.479 ' CD2' HG22 ' A' ' 80' ' ' THR . 52.5 m-85 -85.69 141.53 29.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.105 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.463 ' HB1' ' CE2' ' A' ' 48' ' ' PHE . . . -160.26 113.33 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.809 0.338 . . . . 0.0 111.202 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.409 ' HB2' ' HA ' ' A' ' 78' ' ' LEU . 16.8 p90 -116.08 156.13 26.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.723 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -137.75 149.81 25.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.085 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -107.75 112.43 25.09 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.705 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -111.58 137.61 49.2 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.0 t . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.511 179.451 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.841 0.353 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -118.41 141.69 48.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.608 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.602 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 0.9 OUTLIER -100.79 138.8 37.36 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.771 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.767 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -147.32 119.82 8.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.329 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 2.3 mp -92.87 118.6 31.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.546 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.92 100.02 9.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.081 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.543 ' OG1' HG22 ' A' ' 113' ' ' VAL . 0.2 OUTLIER -80.06 120.97 24.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.403 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -98.96 130.28 45.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.194 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.492 ' O ' HG23 ' A' ' 82' ' ' ILE . 2.7 tt -129.99 96.43 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.104 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.541 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -69.27 108.79 2.6 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.805 179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' C ' ' H ' ' A' ' 86' ' ' VAL . 3.7 mm-40 -34.39 -38.97 0.07 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.756 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 5.6 m-80 -73.15 43.29 0.12 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.391 0.615 . . . . 0.0 111.382 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.516 HG23 HH11 ' A' ' 57' ' ' ARG . 8.6 p -100.94 136.02 34.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.347 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 m -66.55 155.09 38.68 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.18 42.89 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.183 -0.532 . . . . 0.0 113.061 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt -56.89 -43.66 81.51 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.631 0.253 . . . . 0.0 110.922 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.59 -39.04 92.44 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.799 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -49.21 69.57 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.099 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.49 95.12 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.947 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -57.5 -41.95 81.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.7 m -59.09 -43.95 91.88 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.842 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.7 67.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.091 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.8 m -67.6 -37.9 83.22 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.565 0.221 . . . . 0.0 110.7 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.571 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 t70 -57.77 -41.95 83.08 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -30.37 68.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.278 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 m -70.79 -42.69 70.01 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.794 0.33 . . . . 0.0 110.747 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 97' ' ' ASP . 11.2 mt -62.92 -50.93 68.89 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.06 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.434 ' HA ' HG12 ' A' ' 104' ' ' VAL . 14.3 p -59.7 -30.2 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.049 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -67.35 -39.52 85.77 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.793 0.33 . . . . 0.0 110.617 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.74 -35.01 79.18 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.994 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.802 HG13 HG23 ' A' ' 105' ' ' VAL . 14.8 p -87.06 -31.5 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.634 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.802 HG23 HG13 ' A' ' 104' ' ' VAL . 40.8 t -113.38 97.71 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.846 0.355 . . . . 0.0 110.894 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.45 -34.32 6.56 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.689 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.75 84.1 2.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.987 0.422 . . . . 0.0 110.83 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -138.06 164.95 27.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.806 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.95 -48.05 5.03 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 1.9 ttmt -156.55 139.31 15.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.821 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 9.1 pt-20 -135.86 135.25 39.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -151.56 159.5 44.08 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.104 0.478 . . . . 0.0 111.534 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.543 HG22 ' OG1' ' A' ' 80' ' ' THR . 11.4 t -103.94 139.72 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.373 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 113' ' ' VAL . 47.5 mm -134.86 149.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.069 0.461 . . . . 0.0 111.489 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 8.6 t -119.05 -25.75 6.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.493 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.405 ' HB3' ' HB2' ' A' ' 119' ' ' GLU . 38.1 t70 -88.68 146.22 25.19 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.925 0.393 . . . . 0.0 110.895 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.748 ' HA ' HD12 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -69.37 -29.76 67.61 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.668 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.4 -32.96 43.11 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.243 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.445 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 0.5 OUTLIER -75.4 -29.28 59.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.621 -179.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.808 HD22 ' O ' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -95.9 -13.47 23.91 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.763 ' N ' HD13 ' A' ' 120' ' ' LEU . 0.7 OUTLIER -53.74 153.27 4.65 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 121.145 0.498 . . . . 0.0 111.592 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.691 ' HA ' HD12 ' A' ' 125' ' ' ILE . 1.8 tt0 -54.66 -37.54 65.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.895 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -42.1 93.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.84 0.353 . . . . 0.0 110.207 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.445 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 12.2 t80 -70.41 -41.8 72.49 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.0 179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 122' ' ' GLU . 23.8 mt -61.24 -57.58 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.125 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -38.2 74.47 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.415 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.9 t -70.41 -48.64 55.16 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.994 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.14 -44.88 94.29 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.653 0.263 . . . . 0.0 111.074 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.767 HD11 ' CB ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -59.89 -37.38 79.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.577 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.7 tttp . . . . . 0 C--O 1.232 0.176 0 N-CA-C 111.639 0.236 . . . . 0.0 111.639 -179.302 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.819 0.342 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.18 127.71 32.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.517 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -138.82 151.26 46.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.865 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.469 HG12 HG21 ' A' ' 104' ' ' VAL . 0.6 OUTLIER -113.22 127.85 70.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.954 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -80.44 108.91 14.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.52 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.533 ' HE3' HG13 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -65.65 -37.38 86.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.209 -179.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -62.76 -54.01 45.61 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.201 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.698 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.97 -51.84 66.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.163 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 m -54.45 -43.04 71.29 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.881 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 ttp180 -67.73 -42.43 81.9 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.799 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.96 -51.95 64.55 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.98 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.541 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -61.54 -42.35 98.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.926 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.439 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.9 t80 -56.32 -45.22 80.43 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.844 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -57.67 -42.9 84.54 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.092 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.437 HD12 HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -63.99 -44.79 91.6 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.888 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 13' ' ' ALA . 39.2 t -62.93 -33.87 63.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -60.12 -34.79 74.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.69 122.04 24.13 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.567 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -103.21 29.44 5.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.898 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -29.51 4.79 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.911 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.56 171.53 8.96 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.924 0.393 . . . . 0.0 111.362 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.47 56.89 3.45 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.045 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.437 HG11 HD12 ' A' ' 16' ' ' LEU . 39.4 t -140.76 122.9 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.683 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -126.18 -39.41 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.836 ' HB2' HG22 ' A' ' 62' ' ' VAL . 35.9 p-90 -117.44 154.88 30.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.906 0.384 . . . . 0.0 111.181 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.548 HG12 ' HG2' ' A' ' 41' ' ' GLN . 16.3 m -141.73 146.68 22.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.081 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.411 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -88.17 168.59 12.63 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.221 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.45 ' HE1' HG23 ' A' ' 27' ' ' VAL . 25.9 m-85 -148.39 100.77 3.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.283 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.48 155.13 50.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.687 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.8 p90 -106.03 133.2 51.13 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.017 0.437 . . . . 0.0 111.498 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -108.8 120.3 42.08 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.193 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.34 -74.56 1.68 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.227 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.6 37.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.779 0.323 . . . . 0.0 111.227 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.1 t -154.22 131.77 11.36 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.812 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.0 mt -78.0 138.65 19.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.116 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.604 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.1 p -153.6 140.33 12.9 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.944 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.698 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 16.6 Cg_endo -57.12 161.83 10.36 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.603 2.202 . . . . 0.0 112.292 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.403 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.64 -151.26 7.23 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.632 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.0 mp0 -34.73 140.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.619 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.548 ' HG2' HG12 ' A' ' 27' ' ' VAL . 25.8 mt-30 -137.78 97.77 3.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.357 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.79 165.64 25.83 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.598 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.06 -23.14 33.29 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.643 0.258 . . . . 0.0 110.671 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -86.47 106.97 17.85 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.824 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.432 ' HD2' HD11 ' A' ' 49' ' ' ILE . 37.7 t80 -68.76 -21.08 64.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.525 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.818 ' HA ' HD12 ' A' ' 49' ' ' ILE . 14.5 tt0 -48.04 -38.38 17.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.816 0.341 . . . . 0.0 110.675 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.67 -40.62 95.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.23 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -65.52 -43.6 89.55 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.142 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.818 HD12 ' HA ' ' A' ' 46' ' ' GLN . 6.4 mt -59.72 -42.88 90.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.361 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -72.11 -37.81 69.43 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.608 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -38.94 67.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.385 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.606 ' SG ' HD11 ' A' ' 58' ' ' LEU . 5.6 m -86.69 80.4 8.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.637 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.52 161.75 13.47 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.426 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.451 ' HA ' ' CA ' ' A' ' 83' ' ' GLY . 3.1 p-10 -72.84 69.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 111.218 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.772 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.0 OUTLIER -168.07 41.17 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.427 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.721 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.97 -172.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.587 -179.335 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.549 ' HB3' HG22 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -148.5 122.77 9.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.632 0.253 . . . . 0.0 110.525 179.026 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.606 HD11 ' SG ' ' A' ' 52' ' ' CYS . 3.0 pp -153.84 174.05 15.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.048 0.451 . . . . 0.0 111.673 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.512 ' CD2' HG21 ' A' ' 101' ' ' VAL . 5.5 m-85 -107.46 171.75 7.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.691 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.3 162.33 40.89 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.425 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.413 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.9 t80 -150.15 107.17 3.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.836 HG22 ' HB2' ' A' ' 26' ' ' TRP . 11.9 t -126.18 136.18 61.58 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.028 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -109.84 136.51 49.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.605 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -121.8 144.82 48.59 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.347 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -109.04 118.02 35.69 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.97 91.12 3.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.678 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.478 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.3 158.91 30.33 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.593 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -159.84 79.78 0.7 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.916 0.389 . . . . 0.0 111.201 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.02 34.41 2.01 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.123 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -41.54 0.16 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.665 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 t -158.5 82.17 0.82 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.478 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 4.5 mtmt -79.81 110.29 15.03 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.726 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 155.21 44.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.367 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.97 169.2 8.57 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.114 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.57 136.93 11.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.738 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.758 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 50.4 m-85 -84.12 152.64 24.2 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.427 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -151.29 116.11 5.2 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.81 110.38 22.76 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.489 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.609 HG23 HD12 ' A' ' 114' ' ' ILE . 3.6 mp -104.79 126.24 59.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.329 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.9 106.9 16.64 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.35 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.422 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 64.6 t-105 -91.88 132.95 36.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.25 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.537 HG21 HG21 ' A' ' 94' ' ' THR . 5.6 pt -138.52 84.76 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.023 0.44 . . . . 0.0 111.517 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.822 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -59.12 130.93 51.52 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.974 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 86' ' ' VAL . 12.5 mt-10 -30.35 -30.91 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.772 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -75.28 36.64 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.565 0.62 . . . . 0.0 111.719 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.822 HG23 ' O ' ' A' ' 83' ' ' GLY . 98.1 t -88.61 107.46 17.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.293 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.9 t -65.26 165.3 11.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.806 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.38 -47.47 50.71 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.918 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.57 -42.63 99.13 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.598 0.237 . . . . 0.0 110.981 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.534 ' HB3' HG13 ' A' ' 86' ' ' VAL . 2.2 mp0 -70.67 -35.1 72.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.073 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -57.08 -53.69 55.19 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.606 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.87 73.27 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -61.01 -36.69 80.17 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.102 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.537 HG21 HG21 ' A' ' 82' ' ' ILE . 6.6 m -55.64 -52.3 64.29 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.44 0.162 . . . . 0.0 111.006 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.63 -43.89 98.67 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.339 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.4 m -63.35 -47.41 82.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.77 0.319 . . . . 0.0 110.642 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.58 -37.47 81.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.272 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.48 -32.23 70.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.754 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.0 m -72.35 -41.55 66.33 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.461 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.684 ' O ' HG23 ' A' ' 104' ' ' VAL . 40.7 mt -60.13 -50.19 74.67 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.512 HG21 ' CD2' ' A' ' 59' ' ' PHE . 26.4 t -64.33 -36.81 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.0 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -54.17 -44.82 71.82 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.961 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -38.52 70.42 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.749 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 100' ' ' LEU . 59.6 t -58.84 -45.96 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.799 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.439 HG13 ' HE2' ' A' ' 14' ' ' TYR . 39.7 t -96.21 96.18 5.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.585 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.62 -33.18 53.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.424 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -111.13 95.97 5.86 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.824 0.345 . . . . 0.0 110.809 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -126.04 178.36 5.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.111 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.758 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -121.19 -54.9 1.99 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.214 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.447 ' HB2' HD23 ' A' ' 129' ' ' LEU . 7.0 mttm -151.05 132.04 14.26 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.801 0.334 . . . . 0.0 111.452 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -136.6 125.24 23.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.508 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -152.17 161.95 41.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.009 0.433 . . . . 0.0 111.436 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 22.8 t -93.35 149.25 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.617 HD13 ' HA ' ' A' ' 120' ' ' LEU . 42.7 mt -137.19 140.58 42.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.71 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 18.1 p -128.34 23.53 5.95 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.358 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.596 ' H ' HG22 ' A' ' 114' ' ' ILE . 37.0 t70 -143.77 137.58 28.17 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.7 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.529 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 6.6 ttp180 -61.74 -37.02 82.68 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.329 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -70.74 -33.64 71.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.404 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 8.6 mt-10 -76.8 -30.61 56.5 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.078 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.617 ' HA ' HD13 ' A' ' 114' ' ' ILE . 2.6 pp -88.58 -7.41 56.49 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.207 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -54.5 152.64 6.46 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.171 0.51 . . . . 0.0 110.76 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -55.45 -42.28 74.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.27 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.452 ' HB2' ' HB ' ' A' ' 141' ' ' THR . 0.4 OUTLIER -63.99 -31.0 72.04 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.697 -179.372 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.427 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 11.8 t80 -75.5 -46.21 33.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.97 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.472 HD11 ' O ' ' A' ' 120' ' ' LEU . 22.9 mt -58.96 -53.58 45.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -58.59 -35.27 72.14 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.5 t -60.47 -48.0 83.69 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.655 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.53 -41.72 95.03 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.93 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 77' ' ' ALA . 18.0 mt -68.39 -43.42 77.31 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -64.11 -48.16 77.19 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.385 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -72.05 -65.29 0.79 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.959 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 52.8 38.16 25.85 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.792 0.33 . . . . 0.0 111.424 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 128.69 55.52 0.11 Allowed Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.419 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -103.8 -168.35 25.3 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.448 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -101.24 34.29 2.6 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.71 0.29 . . . . 0.0 111.392 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 48.61 42.1 18.6 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.553 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -92.65 54.31 2.22 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.985 0.421 . . . . 0.0 111.161 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -118.75 153.92 33.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -147.62 -56.49 0.24 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.079 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -107.88 16.63 23.33 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.916 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . 0.452 ' HB ' ' HB2' ' A' ' 123' ' ' ASN . 0.0 OUTLIER 52.58 44.57 29.91 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.353 -179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.626 0.251 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.415 HG21 ' HG3' ' A' ' 93' ' ' LYS . 1.0 OUTLIER -99.2 112.46 24.61 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.674 179.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -111.87 145.13 40.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.139 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 16.2 tt -110.59 127.59 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.78 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 6.5 t0 -87.31 115.62 24.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.603 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -70.77 -45.29 65.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.287 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -59.46 -42.77 92.77 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.242 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.777 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -67.03 -56.09 11.57 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.893 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.5 t -55.47 -42.92 74.99 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.877 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -44.89 93.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.863 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.16 -46.9 69.08 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.037 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.435 ' HB1' HG11 ' A' ' 27' ' ' VAL . . . -68.15 -32.35 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.309 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.418 ' HE2' HG13 ' A' ' 105' ' ' VAL . 2.2 t80 -61.03 -56.43 21.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.649 0.261 . . . . 0.0 111.473 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -68.69 -24.55 64.51 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.21 -39.58 22.89 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.568 0.223 . . . . 0.0 111.53 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.93 -32.94 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.419 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -67.81 -23.97 65.24 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.203 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -65.21 98.74 0.34 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -27.84 67.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.092 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -57.41 -34.02 67.49 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.763 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -94.89 156.93 16.13 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.491 ' C ' ' HB2' ' A' ' 43' ' ' ALA . . . -75.95 61.66 1.52 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.507 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.545 HG13 ' HB3' ' A' ' 41' ' ' GLN . 45.8 t -137.35 112.84 10.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.637 HD12 HG13 ' A' ' 62' ' ' VAL . 1.5 pp -125.36 -31.54 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.976 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.5 ' CZ3' HG23 ' A' ' 28' ' ' THR . 34.6 p-90 -122.91 159.49 28.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.002 0.43 . . . . 0.0 111.421 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.709 HG12 ' HG2' ' A' ' 41' ' ' GLN . 6.5 m -138.08 144.86 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.176 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.5 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 1.5 p -103.75 97.06 7.13 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.558 -179.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 10.8 m-85 -78.62 110.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 0.0 110.948 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.439 ' HE2' ' HA3' ' A' ' 39' ' ' GLY . 1.6 pttt -126.63 175.34 8.02 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.311 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -82.13 128.27 33.97 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.6 ' HB2' HG22 ' A' ' 37' ' ' VAL . 0.8 OUTLIER -96.37 69.01 2.61 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.083 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -13.77 10.13 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.284 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 169.51 -31.9 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.956 0.378 . . . . 0.0 111.104 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -91.88 177.18 6.26 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.663 0.268 . . . . 0.0 110.854 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.07 123.01 68.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.018 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 32' ' ' ASP . 28.8 m -147.26 154.65 46.1 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.192 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.777 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.1 Cg_endo -66.27 161.37 40.83 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.519 2.146 . . . . 0.0 112.174 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.439 ' HA3' ' HE2' ' A' ' 30' ' ' LYS . . . -132.7 -151.07 6.59 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.092 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.6 mp0 -27.46 133.57 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.32 0.648 . . . . 0.0 111.993 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.709 ' HG2' HG12 ' A' ' 27' ' ' VAL . 11.0 mt-30 -128.74 99.05 5.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.351 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.86 23.95 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.402 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.491 ' HB2' ' C ' ' A' ' 23' ' ' ALA . . . -86.74 -25.0 24.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 110.837 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.44 118.53 30.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.508 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.525 ' CD2' HG23 ' A' ' 49' ' ' ILE . 13.1 t80 -66.83 -19.6 65.77 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.646 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.02 -40.24 10.28 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 111.069 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -37.19 86.54 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.272 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -70.37 -49.76 45.83 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.313 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.525 HG23 ' CD2' ' A' ' 45' ' ' TYR . 20.2 pt -59.42 -23.51 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.556 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.27 -27.44 18.43 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.304 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.07 -33.91 33.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.747 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.4 p -66.29 81.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.037 0.446 . . . . 0.0 111.844 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -90.82 153.16 20.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -88.24 62.17 6.59 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.997 0.427 . . . . 0.0 111.299 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.743 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.1 t0 -158.85 29.94 0.22 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.231 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.743 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.87 158.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.846 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -106.44 143.7 34.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.465 179.156 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 pp -160.04 147.37 16.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.458 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -86.04 169.57 13.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.945 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 154.86 36.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.467 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -149.71 114.52 5.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.541 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.637 HG13 HD12 ' A' ' 25' ' ' ILE . 16.5 t -124.92 144.18 35.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.152 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.72 143.91 45.76 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.971 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -128.56 158.16 39.22 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.001 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.6 t -134.13 94.84 3.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.586 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.4 p -90.28 108.84 20.01 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.831 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.644 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -155.53 138.74 6.21 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.975 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.466 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.5 OUTLIER -87.13 -178.12 6.17 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.77 17.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.466 ' H ' ' C ' ' A' ' 68' ' ' ASP . 22.9 ptm -123.21 -32.88 3.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.418 0.287 . . . . 0.0 111.549 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.88 171.76 19.86 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 120.636 0.255 . . . . 0.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.644 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -145.59 143.89 30.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.413 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.05 176.15 5.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.732 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -142.3 126.04 17.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.695 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm -119.49 162.97 17.99 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 53.0 m-85 -132.53 131.67 41.82 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.816 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.47 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -130.24 121.05 25.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.169 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.36 100.14 10.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.257 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.755 HG21 HD12 ' A' ' 114' ' ' ILE . 12.3 mt -100.91 145.38 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.162 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.932 ' HB ' HG12 ' A' ' 113' ' ' VAL . 16.1 m -117.18 120.73 39.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.231 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.525 ' CE3' HD11 ' A' ' 120' ' ' LEU . 72.6 t-105 -92.09 143.81 26.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.329 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.534 HG23 HG11 ' A' ' 86' ' ' VAL . 56.8 mt -139.56 111.1 4.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.129 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 85' ' ' ASN . . . -89.44 107.4 3.4 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 113.376 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 7.56 -68.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 178.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.568 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 9.5 m-80 -42.38 -26.25 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.943 0.497 . . . . 0.0 111.925 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.798 HG13 ' HB3' ' A' ' 90' ' ' GLN . 74.3 t -54.06 100.19 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.291 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.7 p -75.33 -178.41 3.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.57 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.44 -47.72 62.06 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.184 -0.531 . . . . 0.0 112.639 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.1 mt -59.02 -46.59 87.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.714 0.293 . . . . 0.0 110.621 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.798 ' HB3' HG13 ' A' ' 86' ' ' VAL . 5.8 mp0 -65.59 -38.56 89.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.521 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -63.49 -39.61 94.89 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 -34.27 77.66 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.071 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.415 ' HG3' HG21 ' A' ' 3' ' ' THR . 0.1 OUTLIER -59.69 -46.27 89.59 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -34.51 73.33 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.76 -51.68 54.0 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.966 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 m -64.34 -37.56 87.94 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.711 0.291 . . . . 0.0 110.665 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.732 ' HA ' HD12 ' A' ' 100' ' ' LEU . 9.1 m-20 -60.56 -40.93 93.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.69 -32.11 68.84 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.574 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.8 m -69.42 -44.13 71.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.771 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.732 HD12 ' HA ' ' A' ' 97' ' ' ASP . 7.5 mt -62.07 -46.64 88.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.855 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 97' ' ' ASP . 21.7 t -67.17 -33.36 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.165 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 ttpp -70.13 -38.39 75.53 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.955 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.89 -30.67 69.22 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.904 HG13 HG23 ' A' ' 105' ' ' VAL . 13.9 p -92.7 -32.03 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.233 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.904 HG23 HG13 ' A' ' 104' ' ' VAL . 26.0 t -122.02 109.41 24.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.925 0.393 . . . . 0.0 110.867 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -18.53 13.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.762 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.04 79.66 2.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.764 0.316 . . . . 0.0 111.024 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.428 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.0 p90 -140.73 159.9 41.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.59 -55.17 2.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.45 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.7 150.05 51.52 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.777 0.322 . . . . 0.0 111.274 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.22 124.62 15.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.078 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.689 ' HE2' HD11 ' A' ' 114' ' ' ILE . 33.2 p90 -160.31 153.44 21.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.897 0.38 . . . . 0.0 111.366 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.932 HG12 ' HB ' ' A' ' 80' ' ' THR . 6.2 m -90.99 153.8 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.975 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.755 HD12 HG21 ' A' ' 79' ' ' ILE . 60.1 mt -139.56 142.18 33.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.928 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.21 25.87 3.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.383 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.539 ' H ' HG22 ' A' ' 114' ' ' ILE . 13.9 t70 -139.14 139.39 37.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.888 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -67.21 -36.78 82.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.999 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -66.2 -45.37 81.01 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.548 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 -25.12 64.8 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.049 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.525 HD11 ' CE3' ' A' ' 81' ' ' TRP . 5.9 mt -73.56 -31.37 63.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.981 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -49.45 136.63 16.07 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.008 0.433 . . . . 0.0 111.385 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -31.08 7.28 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.143 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -59.74 -41.84 91.83 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 120.932 0.396 . . . . 0.0 110.261 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -76.78 -43.46 36.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.111 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.619 HG22 HD13 ' A' ' 129' ' ' LEU . 38.2 mm -60.53 -47.33 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.255 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -62.56 -32.84 73.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.3 t -68.91 -47.58 65.42 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.604 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -66.16 -39.94 90.17 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.135 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.619 HD13 HG22 ' A' ' 125' ' ' ILE . 0.6 OUTLIER -61.57 -23.46 65.99 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.663 -179.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.1 tptm -56.93 -34.25 67.81 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.612 0.244 . . . . 0.0 111.26 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.39 -31.78 67.98 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.174 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.25 32.08 2.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.34 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -120.99 23.19 7.82 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.688 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.61 95.05 0.94 Allowed Glycine 0 C--N 1.335 0.513 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.195 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -171.65 26.46 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -164.68 26.41 0.06 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.737 0.303 . . . . 0.0 111.191 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.6 -30.1 65.43 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.715 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -57.78 144.17 39.41 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.944 0.402 . . . . 0.0 111.377 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -166.11 -47.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.216 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -92.98 14.09 18.7 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.802 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 4.6 m 61.85 92.99 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.307 179.958 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.682 0.277 . . . . 0.0 111.506 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 m -61.85 128.48 36.41 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.849 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -112.6 147.37 36.82 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.02 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.472 HD12 HG21 ' A' ' 36' ' ' ILE . 2.3 tt -109.42 126.98 66.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.52 107.96 13.76 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.509 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 2.2 mttt -63.03 -38.57 91.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.289 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.6 -52.44 65.41 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.143 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.746 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.14 -50.88 68.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.3 m -54.52 -43.43 71.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.117 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -61.35 -45.3 94.98 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.681 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.65 73.62 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.804 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.656 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.54 -52.01 67.01 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.963 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.43 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.9 t80 -56.23 -45.91 79.75 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.89 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -57.23 -46.22 83.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.182 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -43.35 83.99 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.062 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.656 HG23 ' O ' ' A' ' 13' ' ' ALA . 55.1 t -65.84 -33.55 64.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.984 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -59.19 -38.91 81.01 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -80.4 127.99 33.04 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.309 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.7 40.09 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 45.98 0.73 Allowed Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.022 -0.608 . . . . 0.0 112.951 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.573 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.0 OUTLIER -138.07 24.27 2.79 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 54.41 28.67 9.82 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.643 HG11 ' HB3' ' A' ' 41' ' ' GLN . 48.8 t -133.85 125.74 49.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-O 120.579 0.228 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.444 HD11 ' HD1' ' A' ' 26' ' ' TRP . 1.2 pp -113.07 -31.0 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.823 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.639 ' HB2' HG22 ' A' ' 62' ' ' VAL . 37.0 p-90 -127.86 157.66 39.88 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 110.968 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.699 HG12 ' HG2' ' A' ' 41' ' ' GLN . 10.2 m -140.46 144.78 26.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.723 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.421 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 98.0 m -88.28 161.42 17.18 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.696 0.284 . . . . 0.0 110.908 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -144.64 97.17 2.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.99 0.424 . . . . 0.0 110.518 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.86 -178.63 4.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.97 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.596 ' HB3' HD13 ' A' ' 36' ' ' ILE . 39.4 p90 -112.97 118.27 34.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.001 0.429 . . . . 0.0 111.275 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.75 111.45 23.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.192 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.7 -75.41 1.84 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.237 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.27 35.41 0.17 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 111.069 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 t -155.68 140.73 17.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.172 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.596 HD13 ' HB3' ' A' ' 31' ' ' TYR . 33.5 mm -70.61 137.35 24.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.811 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.606 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.6 p -160.27 139.87 8.2 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.996 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.746 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 12.9 Cg_endo -55.28 152.7 30.53 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.822 2.348 . . . . 0.0 112.16 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.421 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -124.62 -150.35 7.83 Favored Glycine 0 N--CA 1.444 -0.829 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.746 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 17.6 mp0 -32.05 136.25 0.07 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.651 0.781 . . . . 0.0 112.727 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.699 ' HG2' HG12 ' A' ' 27' ' ' VAL . 20.0 mt-30 -136.85 97.49 3.54 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.328 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.22 168.94 25.58 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.773 -0.727 . . . . 0.0 113.461 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.77 -20.07 23.97 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.708 0.289 . . . . 0.0 110.618 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -93.24 128.62 39.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.541 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -76.83 -21.29 55.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.787 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -38.55 19.92 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.962 0.41 . . . . 0.0 110.489 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -37.5 87.44 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.401 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.483 ' HE2' HD22 ' A' ' 120' ' ' LEU . 46.1 t80 -69.33 -48.78 60.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.22 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 52.0 mt -62.1 -38.98 82.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.357 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.99 -41.07 87.38 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.673 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -34.01 46.41 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.69 84.95 3.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.9 p -85.85 169.62 13.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.188 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -83.79 17.87 2.17 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.777 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -134.27 65.08 1.58 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.787 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 170.25 143.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.625 -179.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.593 ' HB3' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -112.79 125.84 54.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.631 178.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 pp -153.81 171.93 18.14 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.019 0.437 . . . . 0.0 111.503 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -104.9 167.16 9.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.54 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -153.8 155.32 35.61 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.641 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.494 ' CE1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -145.55 119.16 9.13 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.976 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.639 HG22 ' HB2' ' A' ' 26' ' ' TRP . 22.1 t -128.35 144.37 38.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.951 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.8 mmt85 -100.44 105.33 16.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.613 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -90.17 153.63 20.37 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.86 102.51 5.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.273 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.514 HG21 ' HG2' ' A' ' 130' ' ' LYS . 0.9 OUTLIER -97.96 96.91 8.49 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.858 -179.562 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.568 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.01 154.5 25.54 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.472 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.22 79.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.31 38.36 2.44 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.337 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -156.94 -37.69 0.08 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.313 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.0 p -157.74 79.04 0.86 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.918 0.39 . . . . 0.0 110.556 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.568 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -87.08 106.55 17.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.716 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 37.2 ttp180 -143.52 136.3 27.47 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p -87.38 161.03 18.13 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.306 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.434 ' HE2' HD23 ' A' ' 129' ' ' LEU . 9.3 mtpt -143.17 149.89 38.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.02 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -106.39 118.83 37.66 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.417 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -129.53 119.23 23.35 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.251 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.51 ' HG ' ' HB3' ' A' ' 111' ' ' GLU . 0.5 OUTLIER -99.34 124.61 44.59 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.09 179.444 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.565 HG21 ' CD1' ' A' ' 114' ' ' ILE . 1.1 mt -116.43 145.58 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.687 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -112.5 114.34 26.97 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.288 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.411 ' CD2' HD11 ' A' ' 120' ' ' LEU . 48.1 t-105 -91.99 135.67 33.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.533 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mt -138.2 89.91 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.151 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.685 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -61.09 116.83 9.92 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.975 -0.631 . . . . 0.0 111.664 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.8 mt-10 -29.21 -40.31 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.4 m-80 -72.27 41.55 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.115 0.483 . . . . 0.0 111.985 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.685 HG23 ' O ' ' A' ' 83' ' ' GLY . 20.1 t -107.71 122.76 62.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.11 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -72.4 164.45 26.33 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.85 0.357 . . . . 0.0 111.39 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.17 -44.32 57.2 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.022 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.33 -47.88 77.85 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.638 0.256 . . . . 0.0 110.896 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.453 ' CB ' HG13 ' A' ' 86' ' ' VAL . 0.7 OUTLIER -68.21 -34.97 77.24 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.49 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -60.51 -45.18 94.73 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.89 87.59 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.776 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -53.25 -40.72 64.81 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.857 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 m -56.49 -41.92 77.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.173 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.95 -45.02 97.0 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.624 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -46.35 55.16 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.514 0.197 . . . . 0.0 111.251 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.809 ' HA ' HD12 ' A' ' 100' ' ' LEU . 34.0 m-20 -64.11 -35.06 79.52 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.448 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -55.85 -36.66 67.8 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.877 0.37 . . . . 0.0 110.259 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.5 m -72.95 -42.15 63.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.279 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.809 HD12 ' HA ' ' A' ' 97' ' ' ASP . 9.7 mt -59.78 -48.88 79.89 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.99 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 97' ' ' ASP . 46.9 t -62.38 -46.29 96.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -36.9 76.64 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.947 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.38 -35.83 81.7 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.089 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 100' ' ' LEU . 40.4 t -76.77 -42.92 33.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.43 HG13 ' HE2' ' A' ' 14' ' ' TYR . 36.9 t -119.97 108.56 23.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.032 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.73 -25.38 12.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.586 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -78.89 85.35 4.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.834 0.35 . . . . 0.0 110.782 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -133.24 177.41 7.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.002 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.91 -57.6 2.09 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.501 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.413 ' HE3' ' HG3' ' A' ' 128' ' ' GLU . 35.2 tttm -135.88 140.35 44.05 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.219 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.51 ' HB3' ' HG ' ' A' ' 78' ' ' LEU . 9.1 pt-20 -141.28 132.36 26.26 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.873 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.583 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 11.8 p90 -154.24 168.23 27.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.968 0.413 . . . . 0.0 111.63 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 23.0 t -106.9 145.29 14.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.028 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.593 HG23 ' HB2' ' A' ' 119' ' ' GLU . 84.5 mt -124.65 134.28 67.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.594 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -122.2 17.96 10.72 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.723 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.449 ' H ' HG22 ' A' ' 114' ' ' ILE . 6.8 p-10 -155.3 145.5 21.8 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 111.022 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -61.05 -28.68 69.24 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.497 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -59.93 -46.77 88.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.612 0.244 . . . . 0.0 110.561 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.593 ' HB2' HG23 ' A' ' 114' ' ' ILE . 5.7 mt-10 -66.63 -41.83 87.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.456 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.483 HD22 ' HE2' ' A' ' 48' ' ' PHE . 12.3 mt -53.36 -35.44 60.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.586 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -42.83 126.56 3.8 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.567 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.77 -37.89 44.88 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.007 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -59.24 -46.4 88.58 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.803 0.335 . . . . 0.0 110.619 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -61.41 -50.45 72.81 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.906 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.583 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 32.6 mm -56.93 -45.76 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -48.32 74.53 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.348 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -62.87 -42.43 99.75 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.857 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.413 ' HG3' ' HE3' ' A' ' 110' ' ' LYS . 2.0 tp10 -58.0 -50.91 71.8 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.018 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -65.25 -37.74 88.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.687 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.514 ' HG2' HG21 ' A' ' 66' ' ' THR . 0.0 OUTLIER -69.73 -36.37 75.8 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.666 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -56.53 -42.1 77.9 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.206 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -113.65 87.83 2.7 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 110.369 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.6 60.86 3.66 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.705 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 175.43 -136.55 3.42 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.819 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -103.29 36.77 2.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.781 0.324 . . . . 0.0 111.451 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 51.15 46.87 25.83 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.482 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -70.91 -36.12 72.57 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.905 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.42 147.73 39.71 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.034 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -149.99 -37.9 0.15 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.121 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.99 14.72 5.75 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.008 0.432 . . . . 0.0 111.347 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 12.6 p -135.57 60.93 1.67 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.559 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.302 -179.966 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.011 0.434 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.9 p -120.35 130.29 54.35 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.56 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -119.57 149.11 42.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.097 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.567 ' HB ' HD12 ' A' ' 36' ' ' ILE . 17.1 tt -132.5 131.0 60.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.84 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.07 105.59 13.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.878 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -60.27 -41.47 93.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.786 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -62.42 -43.6 98.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.757 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -64.88 -57.34 9.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.091 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 t -54.33 -43.58 71.34 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.871 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -61.95 -45.18 94.81 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.713 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.68 -50.36 68.42 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.059 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.29 -50.78 72.68 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.627 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -55.94 -43.14 77.16 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.037 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.469 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 68.0 m-20 -64.55 -33.79 76.73 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.793 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -70.63 -46.81 62.63 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.701 0.286 . . . . 0.0 111.15 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.7 t -68.34 -38.69 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.449 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 9.6 ptm180 -67.52 -23.9 65.5 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -74.71 68.26 1.67 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.939 0.399 . . . . 0.0 111.291 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.51 19.67 1.79 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.697 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 52.82 67.13 2.26 Favored Glycine 0 C--N 1.339 0.725 0 C-N-CA 121.081 -0.581 . . . . 0.0 112.56 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 t -64.7 85.03 0.04 OUTLIER 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.717 0.294 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 57.81 27.3 14.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.716 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.592 HG11 ' HB3' ' A' ' 41' ' ' GLN . 67.7 t -143.22 117.8 4.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.493 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -108.11 -29.4 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.444 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.638 ' CB ' HG22 ' A' ' 62' ' ' VAL . 42.5 p-90 -129.78 159.62 35.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.966 0.412 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -144.89 150.51 16.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.908 178.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.473 HG23 ' HE1' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -91.06 162.57 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.027 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -148.18 101.6 3.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.5 pttt -132.23 159.71 38.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 35' ' ' THR . 54.3 p90 -116.01 131.79 56.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.74 103.04 14.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.849 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.84 -73.27 2.13 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.758 . . . . 0.0 111.734 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m -155.45 32.81 0.37 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.724 0.297 . . . . 0.0 111.464 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 0.7 OUTLIER -140.5 117.56 11.19 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.567 HD12 ' HB ' ' A' ' 5' ' ' ILE . 11.2 mt -77.35 133.45 30.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.245 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.546 HG23 ' HB1' ' A' ' 9' ' ' ALA . 11.3 p -151.2 137.72 11.48 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.757 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 19.5 Cg_endo -58.33 158.12 23.77 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.567 2.178 . . . . 0.0 112.639 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.441 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -127.12 -152.17 7.92 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.629 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 10.0 mp0 -35.48 140.81 0.09 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.536 0.734 . . . . 0.0 112.515 -179.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.592 ' HB3' HG11 ' A' ' 24' ' ' VAL . 30.1 mt-30 -139.03 98.2 3.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.518 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.56 167.56 24.74 Favored Glycine 0 C--N 1.333 0.386 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.26 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.493 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -85.41 -20.14 30.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.696 -0.252 . . . . 0.0 110.972 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -93.05 107.58 19.34 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.457 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.94 -21.17 65.11 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -46.34 -39.7 10.67 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.776 0.322 . . . . 0.0 110.631 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -42.55 94.94 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.409 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.705 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 40.0 t80 -68.12 -42.41 80.25 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.878 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.01 -35.13 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.207 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.36 -37.25 25.91 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.694 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.98 -42.55 57.37 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -72.66 84.17 1.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.111 0.481 . . . . 0.0 111.049 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.05 164.48 22.44 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.563 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.4 38.5 0.83 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.777 0.323 . . . . 0.0 111.793 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.757 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -139.47 45.28 1.95 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.922 0.391 . . . . 0.0 111.336 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.48 157.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.812 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.31 134.91 45.91 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.325 179.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.9 mt -147.22 170.42 17.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.063 0.459 . . . . 0.0 111.965 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -119.68 160.5 22.41 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.118 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.705 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -155.81 153.44 29.79 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.897 0.379 . . . . 0.0 111.63 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -139.38 122.62 16.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.578 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.638 HG22 ' CB ' ' A' ' 26' ' ' TRP . 11.5 t -130.53 142.38 43.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.91 0.386 . . . . 0.0 111.628 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -101.92 118.47 36.99 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.717 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -102.15 165.1 11.33 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.98 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.9 m -148.0 112.11 5.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.603 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 45.4 p -99.59 117.07 33.16 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.2 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.513 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.16 157.58 28.91 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.614 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.95 79.12 1.46 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.805 0.336 . . . . 0.0 111.211 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 31.39 49.85 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.8 ptm -177.31 -36.71 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.637 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.9 p -148.23 91.11 1.87 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.913 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.513 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -112.29 122.36 47.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.716 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.69 135.86 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.985 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 149.78 30.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.256 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -144.18 162.71 35.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.602 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 8.2 m-85 -106.35 153.85 21.62 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.795 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.626 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -154.65 125.94 7.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.633 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.3 tt -92.66 127.33 38.12 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.345 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.428 HD13 HD13 ' A' ' 125' ' ' ILE . 29.5 mt -122.02 107.94 20.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.603 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.413 ' HB ' HG22 ' A' ' 113' ' ' VAL . 7.2 m -97.33 132.01 43.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.007 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -114.13 141.84 46.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.871 0.367 . . . . 0.0 111.304 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.6 mt -137.27 104.11 3.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -82.42 124.12 6.37 Favored Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.372 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -27.61 -51.38 0.07 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.722 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 12.9 m-80 -71.41 49.07 0.15 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -178.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.444 HG13 ' O ' ' A' ' 86' ' ' VAL . 7.1 p -112.39 115.4 49.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.389 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.62 160.06 28.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.051 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.83 -44.45 61.09 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.708 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.25 -45.29 88.08 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.79 0.328 . . . . 0.0 110.795 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.45 -44.1 79.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.686 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -59.09 -46.22 88.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.637 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.04 88.37 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.937 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.83 -44.09 81.71 Favored 'General case' 0 N--CA 1.461 0.086 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.764 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.429 ' O ' ' HB2' ' A' ' 98' ' ' LYS . 9.5 m -50.18 -40.05 45.73 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.662 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.83 -46.85 80.16 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.793 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.97 -44.93 79.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.065 0.433 . . . . 0.0 111.114 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -62.33 -36.25 81.59 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.875 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -58.06 -34.48 70.16 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.9 m -71.0 -43.29 68.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.705 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 83.4 mt -59.57 -50.75 72.69 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.128 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.14 -31.66 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.954 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.9 -32.61 72.37 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.105 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -48.67 62.97 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.457 HG23 HG23 ' A' ' 105' ' ' VAL . 6.7 m -71.19 -28.67 33.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.457 HG23 HG23 ' A' ' 104' ' ' VAL . 56.1 t -101.22 102.05 12.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -99.48 -32.03 11.33 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.456 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -85.9 86.12 7.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.818 0.342 . . . . 0.0 111.343 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.468 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 33.6 p90 -140.25 158.01 44.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.702 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -100.83 -59.6 1.67 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.492 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 151.57 47.49 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.283 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -139.69 135.83 33.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.998 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -160.14 165.62 31.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.03 0.443 . . . . 0.0 111.271 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.413 HG22 ' HB ' ' A' ' 80' ' ' THR . 20.2 t -111.24 139.03 37.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.521 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.548 HG22 ' H ' ' A' ' 116' ' ' ASP . 49.2 mt -124.3 142.41 41.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 80.9 p -135.12 26.5 3.54 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.362 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.548 ' H ' HG22 ' A' ' 114' ' ' ILE . 34.6 t70 -138.09 138.05 38.34 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.417 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -60.5 -35.15 75.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.684 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.66 -46.9 71.08 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.535 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 1.7 mp0 -69.39 -28.95 66.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.843 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.461 ' O ' HD11 ' A' ' 125' ' ' ILE . 0.4 OUTLIER -67.01 -30.61 70.76 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.728 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -52.17 132.12 33.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.684 ' HA ' HD12 ' A' ' 125' ' ' ILE . 2.7 tp10 -52.44 -35.07 51.34 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.991 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -61.67 -38.93 89.59 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.868 0.366 . . . . 0.0 110.607 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.535 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 7.9 t80 -68.82 -51.58 39.22 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.684 HD12 ' HA ' ' A' ' 122' ' ' GLU . 5.1 mt -54.68 -40.67 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.964 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -51.26 -41.9 60.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.006 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.7 t -70.88 -42.52 69.91 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.276 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -56.02 -34.65 66.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.711 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.626 HD11 ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -64.99 -50.27 66.99 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.556 0.217 . . . . 0.0 111.408 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 tttm -71.85 -40.97 68.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.283 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -70.98 -38.19 72.72 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.432 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 57.47 49.8 12.27 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 107.49 -64.71 0.26 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.808 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -168.42 103.42 0.2 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.33 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -93.18 19.75 7.69 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.576 0.227 . . . . 0.0 111.465 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 48.58 35.77 6.58 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.376 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.15 62.29 4.76 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.279 0.561 . . . . 0.0 110.721 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -79.46 167.59 20.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.379 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -110.09 -37.85 5.46 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.707 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.74 14.92 15.76 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.71 39.94 29.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.843 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 118.501 -0.761 . . . . 0.0 111.164 -179.955 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.808 0.337 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 m -113.36 91.38 3.63 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.806 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -106.81 164.74 11.86 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.156 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.643 ' HB ' HD12 ' A' ' 36' ' ' ILE . 5.2 tt -115.26 130.38 69.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.021 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.62 101.98 8.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.472 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.36 -41.07 92.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.909 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -59.67 -51.63 68.98 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.948 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.621 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.12 -52.83 63.22 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.951 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.46 -39.39 73.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.153 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.35 -44.94 96.32 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.07 -50.99 67.76 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.25 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.474 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.41 -48.21 73.61 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.264 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.542 ' HE2' HG22 ' A' ' 105' ' ' VAL . 0.7 OUTLIER -56.18 -46.97 79.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.886 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -55.89 -40.84 73.58 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.468 HD21 HG21 ' A' ' 24' ' ' VAL . 15.9 tp -65.46 -44.52 86.92 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.972 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 13' ' ' ALA . 27.6 t -65.89 -35.01 74.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.779 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -61.17 -33.54 73.6 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 22' ' ' SER . 3.5 t70 -54.87 131.21 43.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.034 0.445 . . . . 0.0 111.054 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.74 -38.68 67.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.593 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -155.25 87.55 0.13 Allowed Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.809 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.428 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 3.2 t -118.67 30.14 7.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.769 0.319 . . . . 0.0 111.401 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 58.15 26.92 14.32 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.671 HG11 ' HB3' ' A' ' 41' ' ' GLN . 58.2 t -144.99 125.37 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-O 120.732 0.301 . . . . 0.0 110.906 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.508 HD12 HG23 ' A' ' 62' ' ' VAL . 1.3 pp -112.46 -28.57 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.749 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -131.24 155.61 46.81 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 111.473 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.581 HG22 ' HB3' ' A' ' 61' ' ' PHE . 34.7 m -140.85 149.51 20.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.005 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.63 175.89 6.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.85 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -151.13 93.59 1.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.404 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -102.87 176.0 5.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -89.67 144.11 26.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.111 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.511 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.5 OUTLIER -122.77 79.09 1.6 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.888 178.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.35 -72.58 2.13 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.468 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.4 m -150.13 31.89 0.68 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.806 0.336 . . . . 0.0 110.766 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.0 p -146.39 176.97 9.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.033 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.643 HD12 ' HB ' ' A' ' 5' ' ' ILE . 10.9 mt -106.85 131.39 56.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.182 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.511 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 23.2 m -145.73 138.45 13.89 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.926 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.621 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 32.1 Cg_exo -58.21 168.22 3.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.468 2.112 . . . . 0.0 112.804 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.73 -153.78 7.15 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.993 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.425 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.4 mp0 -35.47 141.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.286 0.634 . . . . 0.0 112.428 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.671 ' HB3' HG11 ' A' ' 24' ' ' VAL . 15.9 mt-30 -136.84 98.12 3.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.356 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.42 168.62 25.76 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.839 -0.695 . . . . 0.0 113.209 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.415 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.88 -19.35 27.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.634 0.254 . . . . 0.0 110.86 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -89.97 111.27 22.29 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.7 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -68.0 -24.53 65.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.603 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.542 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -48.63 -36.09 15.07 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.016 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.25 -35.31 79.92 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.264 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.541 ' HE2' HD11 ' A' ' 120' ' ' LEU . 80.1 t80 -68.03 -40.6 82.86 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.561 0.22 . . . . 0.0 111.04 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.542 HD12 ' HA ' ' A' ' 46' ' ' GLN . 18.1 mt -64.31 -44.69 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.167 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -64.64 -40.8 96.09 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.768 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.39 -29.2 59.75 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.5 83.94 3.9 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.962 0.41 . . . . 0.0 111.35 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.61 173.59 8.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.577 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -78.2 2.8 17.03 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.686 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -126.41 77.37 1.69 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.751 0.31 . . . . 0.0 110.586 -179.659 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.684 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -170.11 -175.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.372 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.419 ' HD3' ' HG2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -169.39 74.36 0.09 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.2 pp -129.39 168.12 16.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.338 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -96.38 170.54 9.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.87 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.418 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -142.0 145.21 34.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.972 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.581 ' HB3' HG22 ' A' ' 27' ' ' VAL . 1.1 t80 -132.77 128.55 37.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 9.8 p -150.38 134.31 8.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.841 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 ttp-105 -103.91 132.38 50.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -104.3 161.65 13.88 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.919 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 65' ' ' THR . 8.9 t -146.16 110.26 4.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.724 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 t -108.56 135.92 49.03 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.347 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.18 136.09 5.06 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.922 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.422 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -80.21 -178.47 6.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.35 8.55 0.31 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.422 ' H ' ' C ' ' A' ' 68' ' ' ASP . 14.1 ptm -157.64 21.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.75 166.5 33.23 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.771 0.319 . . . . 0.0 111.266 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.9 127.55 7.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.187 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.14 155.66 46.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.988 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.1 t -126.92 136.6 52.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.443 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mtmt -137.56 144.31 41.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.435 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.504 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 6.4 m-85 -90.03 153.54 20.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.034 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 62' ' ' VAL . . . -140.31 114.88 9.41 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.243 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.497 HD11 HG12 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -103.33 93.22 4.86 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.638 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.641 HD13 HD13 ' A' ' 125' ' ' ILE . 5.4 mt -96.53 155.61 3.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.879 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.566 ' HB ' HG23 ' A' ' 113' ' ' VAL . 7.1 m -133.72 132.0 40.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.668 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.522 ' CE3' HD22 ' A' ' 120' ' ' LEU . 55.1 t-105 -108.71 129.38 55.36 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.853 0.359 . . . . 0.0 110.97 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.485 ' O ' HG23 ' A' ' 82' ' ' ILE . 2.9 tt -125.73 100.87 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.718 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.413 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -75.37 113.91 4.1 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.086 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.6 mm-40 -24.56 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.686 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.3 m-80 -71.26 44.27 0.09 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.105 0.479 . . . . 0.0 111.67 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 84' ' ' GLU . 9.0 t -77.47 142.58 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.471 179.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 162.05 29.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.029 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.17 -61.92 6.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.975 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -34.55 76.2 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.491 0.186 . . . . 0.0 111.217 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.419 ' HG2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -57.94 -33.36 68.74 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.29 179.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -52.91 -38.38 61.73 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.983 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.3 -37.09 23.9 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.101 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -57.59 -43.32 84.55 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.298 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.6 p -59.26 -37.6 78.02 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.267 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.92 -50.43 60.95 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.613 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.9 t -67.64 -31.54 71.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.624 0.249 . . . . 0.0 111.018 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.62 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.73 -39.17 83.79 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.243 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -57.0 -33.42 67.12 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.786 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.9 m -72.48 -44.33 62.45 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 97' ' ' ASP . 17.5 mt -59.56 -45.31 92.22 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.991 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 78' ' ' LEU . 46.1 t -65.78 -40.04 86.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 -36.6 80.68 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -45.76 78.86 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.739 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 29.6 t -71.87 -45.65 63.99 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.542 HG22 ' HE2' ' A' ' 14' ' ' TYR . 21.3 t -106.04 101.57 12.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.869 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -107.57 -32.24 7.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.443 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -81.44 71.82 8.45 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.903 0.382 . . . . 0.0 110.669 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.475 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 19.9 p90 -124.16 162.26 23.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.068 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.29 -46.52 5.78 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.66 132.0 15.58 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.067 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -133.43 127.87 34.3 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.417 ' HE2' HD11 ' A' ' 114' ' ' ILE . 14.2 p90 -160.35 162.45 33.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.981 0.42 . . . . 0.0 111.604 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.566 HG23 ' HB ' ' A' ' 80' ' ' THR . 11.2 p -109.07 143.02 20.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.534 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.657 HD13 ' HA ' ' A' ' 120' ' ' LEU . 4.4 mt -128.13 136.99 58.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.9 m -100.96 -31.52 11.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.063 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -88.6 139.09 30.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.824 0.345 . . . . 0.0 110.947 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 mmm-85 -70.5 -36.45 73.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.167 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -47.86 77.57 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.674 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -70.07 -23.85 63.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.008 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.657 ' HA ' HD13 ' A' ' 114' ' ' ILE . 6.7 tp -81.61 -21.64 38.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.8 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -47.88 138.78 8.41 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.094 0.473 . . . . 0.0 111.567 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -35.44 21.52 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.049 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -38.84 75.59 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.983 0.42 . . . . 0.0 110.175 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -77.85 -42.04 34.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.641 HD13 HD13 ' A' ' 79' ' ' ILE . 49.8 mt -58.75 -50.09 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.029 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -54.8 -39.32 68.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.2 t -72.4 -44.37 62.57 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -58.12 -48.1 81.26 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.976 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.481 ' CD1' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -61.02 -31.5 71.12 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.101 179.665 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -49.44 71.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.957 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -70.1 -52.24 25.32 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.882 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 59.01 32.55 22.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.462 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 86.78 -49.53 4.04 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.798 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 117.71 107.4 2.4 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.134 -0.555 . . . . 0.0 111.834 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -168.76 25.11 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.69 0.281 . . . . 0.0 111.695 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -150.48 21.14 0.83 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.862 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.15 -56.06 4.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.616 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -81.61 150.37 28.16 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.231 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.07 -56.51 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.194 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -131.97 17.51 4.63 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.66 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 6.3 m 60.22 62.33 1.62 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.464 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.118 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.94 0.4 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.07 130.12 40.35 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.677 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -135.69 -179.9 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.006 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 tt -146.29 133.13 14.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.886 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.592 ' HB3' HG12 ' A' ' 37' ' ' VAL . 6.8 t70 -77.27 112.74 14.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.744 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.44 -45.28 76.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.058 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.81 -50.17 74.84 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.299 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.671 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -60.0 -57.0 14.74 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.305 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.628 ' HB3' HG11 ' A' ' 104' ' ' VAL . 34.2 m -58.49 -46.66 86.24 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.407 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -60.42 -49.66 76.68 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.42 -47.65 69.41 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.903 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.452 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -58.81 -35.03 72.2 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.452 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -66.09 -62.1 1.67 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.31 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -64.08 -32.8 74.5 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.919 0.341 . . . . 0.0 111.919 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.5 tt -61.55 -49.66 75.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.749 0.309 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.489 HG21 HG21 ' A' ' 27' ' ' VAL . 46.7 t -75.4 -32.03 24.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -4.35 41.5 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.896 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -70.96 80.8 0.65 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.813 0.34 . . . . 0.0 111.14 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 52.92 25.37 3.92 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.386 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 68.25 72.53 0.8 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.092 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 26.4 p -66.55 -169.98 0.09 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.524 0.202 . . . . 0.0 110.932 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.85 52.88 1.29 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.836 0.351 . . . . 0.0 111.15 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.576 HG11 ' HB3' ' A' ' 41' ' ' GLN . 49.4 t -152.92 101.77 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.281 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.486 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -85.81 -27.35 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.644 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.471 ' HD1' HD11 ' A' ' 25' ' ' ILE . 21.9 p-90 -138.46 153.85 48.84 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.344 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.778 HG13 ' HG2' ' A' ' 41' ' ' GLN . 3.4 t -139.45 152.67 23.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.992 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.582 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 1.7 m -92.15 165.85 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.757 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -149.69 99.45 2.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.225 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 153.09 52.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.855 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 36' ' ' ILE . 55.1 p90 -96.07 128.77 43.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.414 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.19 109.02 21.85 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.842 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.62 -50.66 3.87 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.195 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.6 p -171.14 -33.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.1 t -83.5 132.62 34.93 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.876 0.37 . . . . 0.0 111.41 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.476 ' HA ' ' HA ' ' A' ' 31' ' ' TYR . 50.7 mt -79.5 136.07 24.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.954 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.592 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.6 m -151.03 155.94 35.19 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.28 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.671 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 43.3 Cg_endo -67.86 164.72 30.51 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.318 2.012 . . . . 0.0 112.09 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.582 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -134.38 -150.76 6.23 Favored Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.554 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.6 mp0 -31.59 136.13 0.06 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.461 0.705 . . . . 0.0 112.579 -179.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.778 ' HG2' HG13 ' A' ' 27' ' ' VAL . 8.2 mt-30 -130.69 91.37 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.228 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.66 164.18 25.18 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.26 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.486 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -88.35 -23.46 23.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.686 0.279 . . . . 0.0 110.718 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.96 115.51 22.85 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.688 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.427 ' HD2' HD11 ' A' ' 49' ' ' ILE . 30.3 t80 -67.22 -22.46 65.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.93 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -48.07 -37.2 14.59 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.663 179.512 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -38.67 91.87 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.298 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 47.0 t80 -67.91 -41.73 82.23 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.633 0.254 . . . . 0.0 111.013 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 46' ' ' GLN . 21.8 mt -63.51 -42.49 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.64 -40.5 73.05 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.642 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -34.29 68.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.623 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.5 m -76.44 82.98 3.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.961 0.41 . . . . 0.0 111.431 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.49 162.18 24.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -84.83 13.27 6.04 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.777 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -129.2 52.71 1.94 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 110.721 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.777 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 171.69 148.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.847 -179.492 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.537 ' HB3' HG23 ' A' ' 82' ' ' ILE . 0.0 OUTLIER -111.3 129.13 56.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.73 179.554 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.43 174.47 10.6 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -115.79 167.2 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.264 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -151.82 154.01 35.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.848 0.356 . . . . 0.0 111.415 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.506 ' CE1' HG11 ' A' ' 105' ' ' VAL . 1.7 t80 -136.21 110.07 8.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.12 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 t -115.29 122.68 69.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.723 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.41 107.72 18.79 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.84 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -103.59 159.17 15.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.052 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 6.8 t -148.51 127.17 12.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.823 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.1 p -113.99 88.71 2.91 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.061 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.401 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.36 175.25 37.13 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.553 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -159.91 79.16 0.69 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.842 0.353 . . . . 0.0 111.072 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 46.55 31.11 1.25 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.55 -34.84 0.18 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.527 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -158.42 80.14 0.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.995 0.426 . . . . 0.0 110.551 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.401 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 3.6 mttt -79.67 98.61 7.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.802 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.419 ' O ' ' HA ' ' A' ' 65' ' ' THR . 4.8 tpp180 -100.41 110.97 23.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.798 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.5 140.58 29.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.019 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HD3' ' HG ' ' A' ' 129' ' ' LEU . 20.6 mttm -130.87 121.99 26.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.961 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -96.08 117.6 31.03 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.426 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.721 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -119.07 138.39 52.91 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.488 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 11.5 tp -117.7 100.18 7.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.559 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 39.0 mt -85.95 113.66 24.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.077 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.439 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 4.5 m -99.53 108.69 21.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.528 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.1 t-105 -98.52 141.12 31.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.885 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.537 HG23 ' HB3' ' A' ' 57' ' ' ARG . 46.2 mt -139.9 94.1 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.261 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.693 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -62.84 109.77 2.9 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.518 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 86' ' ' VAL . 5.3 mm-40 -33.78 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.662 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.6 m-80 -73.13 41.81 0.11 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.273 0.558 . . . . 0.0 111.575 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.693 HG13 ' O ' ' A' ' 83' ' ' GLY . 2.5 m -99.26 137.33 27.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.348 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 m -66.28 165.55 13.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.772 0.32 . . . . 0.0 111.23 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.08 -36.47 67.89 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.98 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.81 -36.12 82.86 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.553 0.216 . . . . 0.0 111.083 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.95 -36.77 84.55 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.042 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.94 -45.27 78.84 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.782 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -35.71 74.19 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.197 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.11 -41.82 68.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.475 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -58.04 -39.26 77.99 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.136 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.23 -49.21 67.64 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.379 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -42.94 88.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.586 0.231 . . . . 0.0 110.964 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.559 ' O ' HG23 ' A' ' 101' ' ' VAL . 0.8 OUTLIER -60.39 -36.11 77.34 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.179 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -34.53 65.75 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.907 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 59.1 m -76.45 -47.79 21.85 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.903 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.401 ' O ' HG23 ' A' ' 104' ' ' VAL . 67.6 mt -60.87 -47.85 84.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.178 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 97' ' ' ASP . 45.5 t -64.59 -40.12 87.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.764 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -57.61 -44.96 85.86 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.856 179.376 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -59.7 -41.88 91.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.628 HG11 ' HB3' ' A' ' 10' ' ' CYS . 25.8 t -72.28 -37.8 59.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.409 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.506 HG11 ' CE1' ' A' ' 61' ' ' PHE . 21.6 t -125.52 104.15 12.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 120.873 0.368 . . . . 0.0 110.823 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 2.9 mt-30 -109.23 -40.38 4.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.095 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -86.62 85.5 7.3 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.059 0.457 . . . . 0.0 111.109 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -133.61 160.41 37.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.982 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.65 -51.18 29.61 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.03 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.8 161.7 3.87 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 6.6 pt-20 -148.08 150.04 33.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.051 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.618 ' CE1' HD11 ' A' ' 114' ' ' ILE . 12.2 p90 -157.41 160.79 38.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.152 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.439 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 10.2 p -102.32 142.59 16.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.99 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.618 HD11 ' CE1' ' A' ' 112' ' ' PHE . 3.9 mt -134.68 141.85 42.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.063 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 t -135.15 31.26 3.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.848 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.566 ' H ' HG22 ' A' ' 114' ' ' ILE . 30.4 t70 -145.12 136.55 25.18 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.705 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -59.0 -36.56 75.12 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.68 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -69.17 -44.7 71.69 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.556 0.217 . . . . 0.0 110.84 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.431 ' HB2' HG23 ' A' ' 114' ' ' ILE . 45.1 mt-10 -73.35 -31.22 63.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.159 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.405 ' N ' HG21 ' A' ' 114' ' ' ILE . 3.5 tp -74.0 -28.55 61.51 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.09 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -45.45 133.18 7.63 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.448 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -51.14 -32.15 22.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.1 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -56.71 -41.38 77.31 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.976 0.417 . . . . 0.0 110.29 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -70.43 -46.01 64.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.903 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.476 HG21 HD11 ' A' ' 79' ' ' ILE . 20.1 mm -61.14 -46.12 97.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.228 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -60.53 -37.87 82.58 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.619 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.62 -42.26 74.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.657 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.16 -43.13 99.36 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.093 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.721 HD11 ' HB2' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -65.73 -43.4 89.13 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.237 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -64.31 -32.29 73.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.16 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.57 -49.36 36.92 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.239 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -110.14 43.27 1.39 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.983 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -139.01 -50.83 0.05 OUTLIER Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.974 -0.631 . . . . 0.0 112.717 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -92.2 -163.61 37.99 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.599 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -117.96 33.82 5.45 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.673 0.273 . . . . 0.0 111.282 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 50.6 47.65 23.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.042 0.449 . . . . 0.0 110.985 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -68.94 -26.97 65.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.562 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -59.03 154.52 15.42 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.067 0.461 . . . . 0.0 110.934 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -113.68 -20.34 11.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.546 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -91.17 13.62 16.52 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 11.1 t -158.45 46.09 0.32 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.087 0.47 . . . . 0.0 110.932 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.91 179.824 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.649 0.262 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 m -121.25 144.38 48.64 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.743 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -134.48 167.37 20.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.025 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -123.29 122.82 66.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.426 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.525 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 4.0 t70 -75.31 107.18 7.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -70.31 -36.88 74.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.777 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -66.75 -46.64 74.75 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.91 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.809 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -64.77 -51.63 61.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.302 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.2 t -55.48 -44.8 76.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -65.77 -44.01 87.15 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.77 -49.61 47.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.131 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.705 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -70.56 -36.87 73.88 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.651 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -55.35 -55.1 35.42 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.54 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.443 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 21.6 p30 -75.23 -20.97 58.95 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.3 -44.18 46.94 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.612 0.244 . . . . 0.0 111.318 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 13' ' ' ALA . 19.4 t -72.5 -40.16 62.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.513 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -59.16 -25.75 64.17 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.49 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.31 125.58 27.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.807 0.337 . . . . 0.0 110.797 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -90.42 35.49 0.87 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.256 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.45 -32.44 2.14 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.941 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.26 157.98 16.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.05 0.425 . . . . 0.0 111.33 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.88 59.34 3.13 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.65 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.2 t -129.0 108.42 17.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.033 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.463 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.2 pt -106.32 -29.89 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.651 ' HB2' HG22 ' A' ' 62' ' ' VAL . 31.0 p-90 -135.16 155.99 49.76 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.928 0.394 . . . . 0.0 111.179 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 16.7 m -141.38 149.05 20.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.225 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.533 HG22 ' H ' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -92.68 175.94 6.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.59 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.556 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 5.6 m-85 -144.82 104.73 4.04 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.007 179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.98 -179.2 4.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.401 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -84.09 163.74 19.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.52 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.453 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -147.36 84.63 1.57 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.817 179.333 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 75.15 -68.64 2.0 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.303 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -156.68 34.88 0.31 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.8 t -158.39 158.46 34.28 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.428 HG12 ' OD2' ' A' ' 97' ' ' ASP . 3.6 mt -84.93 134.6 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.12 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.458 ' HB ' ' HD2' ' A' ' 38' ' ' PRO . 30.7 m -147.54 157.36 44.85 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.009 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.809 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.9 Cg_endo -65.88 171.37 9.99 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.335 2.023 . . . . 0.0 112.146 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.498 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -135.91 -151.91 6.25 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.53 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.531 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.35 140.27 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.418 0.687 . . . . 0.0 112.248 -179.471 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -135.33 100.94 4.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.184 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.52 161.5 24.48 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.128 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.463 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.56 -26.75 34.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 0.0 110.52 179.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -96.04 122.42 38.85 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.533 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -68.2 -18.09 64.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.905 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.719 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -47.58 -40.12 18.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.623 0.249 . . . . 0.0 110.973 179.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.19 -39.66 91.03 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.226 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 39.8 t80 -66.43 -47.6 72.67 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.893 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.719 HD12 ' HA ' ' A' ' 46' ' ' GLN . 4.9 mt -58.18 -38.5 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.714 0.292 . . . . 0.0 110.781 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.41 -36.38 83.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.574 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.06 -23.44 22.55 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.599 ' SG ' HD22 ' A' ' 120' ' ' LEU . 0.4 OUTLIER -73.46 81.97 1.45 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.212 -179.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.2 p -109.48 146.13 35.09 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.638 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.583 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.7 m-20 -80.07 70.14 6.61 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.01 0.433 . . . . 0.0 111.385 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.706 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.9 t70 -165.5 45.08 0.08 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.204 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.765 HG13 ' N ' ' A' ' 57' ' ' ARG . 2.9 p 178.29 -147.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.765 ' N ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -163.71 123.41 2.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.392 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.1 pp -158.85 156.8 30.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.878 0.371 . . . . 0.0 111.322 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.556 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 67.3 m-85 -99.69 172.21 7.41 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.554 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -150.22 156.22 41.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -147.24 122.11 9.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.68 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.651 HG22 ' HB2' ' A' ' 26' ' ' TRP . 14.8 t -130.98 143.05 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-O 120.888 0.375 . . . . 0.0 111.507 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.478 ' HD2' HG12 ' A' ' 17' ' ' VAL . 60.7 mtt85 -121.71 112.67 18.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.551 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.598 ' HD2' HD22 ' A' ' 129' ' ' LEU . 16.2 m-85 -95.45 165.52 12.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.269 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 20.2 m -138.54 120.28 15.25 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.777 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 p -112.13 91.42 3.65 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.83 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.426 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -159.34 172.39 35.99 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.451 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -159.25 79.27 0.75 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 0.0 111.28 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.36 30.74 0.74 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.413 ' HG3' ' N ' ' A' ' 71' ' ' SER . 4.1 ptm -149.82 -34.23 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.413 ' N ' ' HG3' ' A' ' 70' ' ' MET . 28.9 p -158.87 81.77 0.79 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.708 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.426 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 18.1 tttm -79.63 101.09 8.15 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.368 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.437 ' O ' ' HA ' ' A' ' 65' ' ' THR . 8.6 mmt180 -102.34 149.39 24.39 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.028 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.36 147.74 32.23 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.534 ' HG2' HD23 ' A' ' 129' ' ' LEU . 2.2 tptt -130.25 162.04 29.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.932 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.428 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 14.7 m-85 -130.37 146.92 52.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.617 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.593 ' HB2' HD11 ' A' ' 129' ' ' LEU . . . -146.76 111.51 5.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.494 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 14.8 tp -103.48 86.74 2.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.895 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.725 HG21 HD12 ' A' ' 114' ' ' ILE . 2.2 mp -96.26 141.4 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.249 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.7 m -114.35 124.18 51.34 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.431 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.52 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 68.7 t-105 -94.18 133.55 37.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.834 0.349 . . . . 0.0 110.745 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.512 ' O ' HG23 ' A' ' 82' ' ' ILE . 3.0 tt -128.33 90.82 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.837 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.583 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.56 111.33 4.06 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.709 -0.757 . . . . 0.0 111.692 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -37.07 -45.84 0.63 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -178.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.706 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 6.1 m-80 -73.68 46.54 0.22 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.53 0.681 . . . . 0.0 111.423 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 90' ' ' GLN . 12.4 p -104.89 134.59 45.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.25 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 p -63.17 153.87 33.02 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.938 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.36 58.58 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 113.2 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -43.25 92.22 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.797 0.299 . . . . 0.0 111.073 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.469 ' HB2' HG22 ' A' ' 86' ' ' VAL . 31.5 mm-40 -67.68 -33.78 75.61 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.997 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.408 ' O ' HG22 ' A' ' 94' ' ' THR . 0.0 OUTLIER -57.4 -34.63 69.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.951 179.446 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.56 -33.93 27.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.949 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 6.5 tptt -56.13 -44.07 78.82 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.477 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.408 HG22 ' O ' ' A' ' 91' ' ' ARG . 8.6 t -61.35 -34.16 74.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.727 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.54 -48.88 82.16 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.06 -0.59 . . . . 0.0 112.103 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -38.44 86.35 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.568 0.223 . . . . 0.0 110.718 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.53 ' HA ' HD12 ' A' ' 100' ' ' LEU . 4.5 m-20 -60.98 -44.88 96.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.099 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.4 ttpt -58.79 -29.9 67.18 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.8 m -71.99 -45.37 61.23 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.448 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 97' ' ' ASP . 6.2 mt -62.33 -47.65 83.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.098 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.414 ' HA ' HG12 ' A' ' 104' ' ' VAL . 12.5 p -66.2 -32.77 59.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -68.46 -38.18 80.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.763 0.316 . . . . 0.0 110.837 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.23 -47.22 68.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.784 HG13 HG23 ' A' ' 105' ' ' VAL . 14.8 p -71.04 -33.13 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.642 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.784 HG23 HG13 ' A' ' 104' ' ' VAL . 21.9 t -109.17 91.87 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.939 0.399 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -98.83 -35.96 9.95 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.046 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -79.43 79.78 5.86 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 110.829 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -127.84 -179.78 5.13 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.866 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -114.11 -50.98 2.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.344 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.461 ' HE2' ' HB2' ' A' ' 132' ' ' ALA . 1.8 mttp -145.16 150.96 37.69 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.258 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 7.7 pt-20 -151.99 128.39 10.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.896 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.573 ' HE2' HD11 ' A' ' 114' ' ' ILE . 16.4 p90 -159.78 159.43 32.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.341 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.73 146.1 7.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.727 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.725 HD12 HG21 ' A' ' 79' ' ' ILE . 58.7 mt -132.85 144.71 35.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.11 31.26 2.43 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.078 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.532 ' H ' HG22 ' A' ' 114' ' ' ILE . 38.6 t70 -147.07 140.54 25.54 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.916 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.501 ' HA ' HD21 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -60.9 -34.96 75.47 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.462 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.1 tttm -75.3 -37.85 60.62 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.73 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.48 ' CB ' HG23 ' A' ' 114' ' ' ILE . 30.7 mt-10 -67.2 -45.09 77.91 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.825 179.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.599 HD22 ' SG ' ' A' ' 52' ' ' CYS . 4.5 pp -72.02 -22.15 61.45 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.343 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -48.27 133.57 15.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.769 0.319 . . . . 0.0 110.874 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -49.15 -34.09 13.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.058 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -60.09 -46.29 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.894 0.378 . . . . 0.0 110.285 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -68.51 -44.23 75.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.107 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.412 HG22 HD13 ' A' ' 129' ' ' LEU . 37.5 mm -59.85 -45.24 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.13 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -57.34 -39.85 76.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.105 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.7 t -71.52 -46.19 60.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.727 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -57.08 -39.84 75.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.598 HD22 ' HD2' ' A' ' 64' ' ' PHE . 1.9 mp -72.51 -37.75 68.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.522 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -68.84 -56.27 8.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.5 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -75.23 -58.68 3.13 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.101 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.461 ' HB2' ' HE2' ' A' ' 110' ' ' LYS . . . 53.14 40.49 31.31 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.843 0.354 . . . . 0.0 111.517 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -94.54 -39.78 4.62 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.638 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.77 20.86 70.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 121.255 -0.498 . . . . 0.0 113.466 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -173.24 24.01 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -148.91 21.6 0.99 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.959 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -89.53 -49.37 6.72 Favored 'General case' 0 N--CA 1.456 -0.151 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.694 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -131.66 159.56 37.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.069 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -115.31 -35.6 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.552 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.96 18.14 12.53 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 111.66 0.244 . . . . 0.0 111.66 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 14.4 t 44.11 47.4 7.46 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.797 0.439 . . . . 0.0 111.796 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.874 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 120.578 0.228 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.87 102.32 10.84 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.601 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -104.86 162.28 13.46 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.09 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -118.73 135.45 59.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.07 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.32 115.02 22.83 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.4 -41.64 93.44 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.078 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -67.32 -44.78 78.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.147 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.672 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -60.24 -59.57 5.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.238 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.8 m -55.73 -43.68 76.82 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.384 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -65.02 -41.66 95.08 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.484 ' HA ' ' ND2' ' A' ' 15' ' ' ASN . . . -55.18 -55.53 30.21 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.845 0.355 . . . . 0.0 110.733 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.504 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -59.59 -38.49 81.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.674 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -57.68 -50.53 72.88 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.484 ' ND2' ' HA ' ' A' ' 12' ' ' ALA . 13.0 p30 -62.13 -29.49 70.37 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.84 -45.36 15.65 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.691 0.281 . . . . 0.0 111.34 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.689 HG11 HG11 ' A' ' 27' ' ' VAL . 27.1 m -64.82 -29.75 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.698 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -56.62 -40.07 74.73 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.177 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.68 124.12 20.62 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.604 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.72 39.48 1.21 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.223 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -165.74 37.34 0.27 Allowed Glycine 0 C--N 1.335 0.506 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.836 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -123.49 26.02 8.01 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.907 0.354 . . . . 0.0 111.483 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 60.1 28.01 17.52 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.713 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 41' ' ' GLN . 60.3 t -139.13 114.54 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.74 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.483 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.3 pt -110.97 -27.56 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 40.8 p-90 -128.19 161.82 28.41 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.883 0.373 . . . . 0.0 111.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.689 HG11 HG11 ' A' ' 17' ' ' VAL . 0.8 OUTLIER -144.07 151.87 16.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.521 179.178 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.455 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 64.0 m -93.21 161.08 14.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.692 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -146.12 99.24 3.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.997 0.427 . . . . 0.0 110.274 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.23 -179.57 5.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.703 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.925 ' HB3' HD13 ' A' ' 36' ' ' ILE . 52.2 p90 -131.54 132.94 44.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.204 0.526 . . . . 0.0 111.547 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -104.03 114.0 27.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.238 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.67 -74.35 1.78 Allowed Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.998 -179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 m -162.09 33.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.542 0.21 . . . . 0.0 111.515 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.4 p -140.7 134.58 30.55 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.851 0.357 . . . . 0.0 111.039 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.925 HD13 ' HB3' ' A' ' 31' ' ' TYR . 39.9 mm -81.69 130.9 35.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.814 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.448 HG12 ' CB ' ' A' ' 9' ' ' ALA . 16.7 m -152.62 142.59 15.01 Favored Pre-proline 0 C--O 1.233 0.212 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.213 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.672 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 38.2 Cg_exo -60.24 165.7 10.4 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.504 2.136 . . . . 0.0 112.276 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.455 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -134.95 -149.05 5.8 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.449 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.449 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 3.1 mp0 -34.88 136.48 0.16 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.388 0.675 . . . . 0.0 112.514 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.411 ' HB3' HG11 ' A' ' 24' ' ' VAL . 14.2 mt-30 -137.32 98.87 3.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.281 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.68 165.85 27.09 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.415 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.483 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -83.32 -22.04 33.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.679 -0.26 . . . . 0.0 110.79 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -88.45 109.44 20.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.537 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -66.86 -21.12 66.02 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.4 -39.2 21.67 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.767 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.51 -36.97 84.25 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.3 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 45.9 t80 -70.11 -42.08 73.13 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.903 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 63.3 mt -60.51 -40.41 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.753 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -70.8 -36.15 72.86 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.438 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -34.34 58.59 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.695 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.29 82.96 1.38 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 111.656 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.16 155.9 25.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.77 11.27 6.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.757 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -128.25 53.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.833 0.349 . . . . 0.0 110.912 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 173.48 153.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.143 -179.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.72 ' HB3' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -111.18 143.1 42.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.738 179.289 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -160.55 177.22 10.74 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.785 0.326 . . . . 0.0 111.591 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -116.49 158.73 23.13 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.937 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -147.99 164.27 34.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.985 0.421 . . . . 0.0 111.614 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.437 ' CE2' HG11 ' A' ' 105' ' ' VAL . 2.4 t80 -150.81 121.48 7.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.242 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 39.7 t -124.96 134.34 67.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.601 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -93.08 113.8 26.15 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.217 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.4 143.22 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.373 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.423 ' O ' HG23 ' A' ' 65' ' ' THR . 5.6 t -152.3 104.27 2.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.497 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.28 94.45 5.05 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.859 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.56 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.18 146.78 13.12 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.83 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.27 79.84 1.24 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.768 0.318 . . . . 0.0 110.973 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 41.45 62.53 1.5 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.298 0.57 . . . . 0.0 112.092 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -179.08 -46.92 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.3 m -158.71 100.2 1.6 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.322 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.56 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 4.2 mttt -93.24 128.36 39.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.093 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -133.32 102.83 5.7 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.219 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.08 127.54 53.57 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.677 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -144.79 157.07 44.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.874 0.369 . . . . 0.0 111.366 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 15.5 m-85 -110.78 137.81 47.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.591 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.74 128.54 37.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.27 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 79' ' ' ILE . 1.4 tt -89.78 132.19 35.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.443 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 125' ' ' ILE . 14.8 mt -123.92 125.02 70.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.496 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.745 ' HB ' HG12 ' A' ' 113' ' ' VAL . 8.9 m -106.54 119.82 40.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.093 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.62 ' CE3' HD12 ' A' ' 120' ' ' LEU . 37.6 t-105 -98.52 137.4 37.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.921 0.391 . . . . 0.0 111.498 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.511 HG23 HG11 ' A' ' 86' ' ' VAL . 53.3 mt -137.4 87.27 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.932 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.5 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -63.2 106.46 1.33 Allowed Glycine 0 C--N 1.331 0.3 0 CA-C-N 115.785 -0.643 . . . . 0.0 113.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 1.02 -65.22 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 30.4 m-80 -45.94 -21.66 0.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.72 HG21 ' HB3' ' A' ' 57' ' ' ARG . 53.5 t -54.53 107.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.615 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 m -74.3 173.07 10.73 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.33 -43.15 57.37 Favored Glycine 0 C--N 1.336 0.567 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.061 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.58 -46.99 73.83 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.713 0.292 . . . . 0.0 110.808 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.693 ' HB3' HG13 ' A' ' 86' ' ' VAL . 9.3 mp0 -68.24 -37.67 81.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.358 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.428 ' O ' HG22 ' A' ' 94' ' ' THR . 7.6 mmt180 -58.03 -35.87 71.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 -38.91 71.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.93 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -59.72 -49.05 79.23 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.164 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.486 ' HB ' ' HD2' ' A' ' 57' ' ' ARG . 9.2 t -61.04 -33.38 73.21 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.23 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.72 93.65 Favored Glycine 0 C--N 1.337 0.585 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.963 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.18 -38.72 66.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.56 0.219 . . . . 0.0 110.498 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -58.19 -41.4 83.87 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.344 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -55.79 -33.68 64.6 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.745 0.307 . . . . 0.0 110.648 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.2 m -70.52 -44.43 67.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.426 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 61.9 mt -58.38 -49.35 77.56 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.674 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 22.1 t -64.98 -38.85 83.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.022 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 ttmt -60.95 -44.34 97.41 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.145 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -58.42 -45.34 88.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.69 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 t -74.89 -41.05 46.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.674 HG13 ' HE2' ' A' ' 14' ' ' TYR . 38.8 t -104.53 74.48 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 121.067 0.461 . . . . 0.0 110.754 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -77.62 -26.37 50.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.418 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.98 83.57 5.86 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.843 0.354 . . . . 0.0 110.73 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -132.42 158.43 42.02 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.897 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -110.51 -48.93 3.1 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.341 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.55 116.7 7.88 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.026 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -122.32 131.21 53.79 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.964 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -158.01 154.95 28.52 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.028 0.442 . . . . 0.0 111.51 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.745 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.3 m -89.68 156.28 3.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.357 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.57 HG22 ' H ' ' A' ' 116' ' ' ASP . 57.8 mt -138.51 140.6 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.955 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 t -124.25 13.35 8.93 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.78 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.57 ' H ' HG22 ' A' ' 114' ' ' ILE . 8.7 p-10 -148.44 144.28 27.32 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.942 0.401 . . . . 0.0 110.871 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -60.27 -29.71 68.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.989 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -46.75 88.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.731 0.301 . . . . 0.0 110.855 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.422 ' CB ' HG23 ' A' ' 114' ' ' ILE . 1.0 OUTLIER -74.26 -25.81 59.84 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.621 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.62 HD12 ' CE3' ' A' ' 81' ' ' TRP . 0.4 OUTLIER -83.41 -22.77 32.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.675 0.274 . . . . 0.0 111.045 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.431 ' HG2' ' OD1' ' A' ' 123' ' ' ASN . 12.5 tt0 -54.48 133.13 45.81 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.76 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -49.15 -45.08 43.29 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.177 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.431 ' OD1' ' HG2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -58.48 -32.79 69.1 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.25 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.414 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 20.6 t80 -74.81 -51.01 15.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.824 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 79' ' ' ILE . 21.6 mt -59.0 -48.18 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.071 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -55.0 -38.6 68.06 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.057 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.9 t -66.09 -49.11 68.69 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.04 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -60.26 -50.27 74.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.91 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.09 -37.19 84.12 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.4 tttp -69.5 -45.48 68.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.612 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp -74.45 -68.05 0.57 Allowed 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.057 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 55.38 51.84 12.31 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.87 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -121.13 33.51 4.34 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.096 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . -127.56 88.96 0.33 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.296 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 75.88 19.6 1.9 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.884 0.373 . . . . 0.0 111.278 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -155.06 24.73 0.43 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.743 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -63.99 -27.82 69.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.59 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -64.85 157.36 28.05 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.971 0.415 . . . . 0.0 111.02 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -172.58 -64.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.94 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -143.5 16.92 1.85 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.872 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.5 m -95.66 -52.14 4.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.065 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.686 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.429 ' CB ' HG21 ' A' ' 96' ' ' THR . . . . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.797 0.332 . . . . 0.0 111.26 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.12 139.89 45.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -100.25 147.21 26.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.516 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.447 ' HB ' HD13 ' A' ' 100' ' ' LEU . 2.9 tt -124.68 131.05 73.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -89.08 108.11 19.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.565 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -67.9 -34.05 75.89 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.153 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -54.89 40.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.218 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -67.97 -46.28 71.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.339 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 m -58.32 -45.09 88.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.302 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -68.77 -45.08 72.31 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.52 -46.66 73.56 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.781 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.569 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -62.07 -47.62 83.84 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.922 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -56.2 -43.32 78.37 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.143 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -59.44 -46.17 89.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.55 HD22 ' NE2' ' A' ' 41' ' ' GLN . 1.4 tt -65.31 -43.75 90.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.826 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 13' ' ' ALA . 47.6 t -66.72 -31.18 52.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.729 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -37.71 70.57 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.699 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.95 125.62 26.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.703 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -99.34 25.59 6.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.049 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.16 -32.35 4.06 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.862 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -82.91 159.93 22.21 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.834 0.317 . . . . 0.0 111.112 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.45 ' O ' HG23 ' A' ' 25' ' ' ILE . . . -62.85 -22.27 66.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.795 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.5 t -54.77 118.54 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.604 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 43' ' ' ALA . 31.7 pt -113.78 -36.29 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.718 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.688 ' CB ' HG22 ' A' ' 62' ' ' VAL . 37.3 p-90 -136.21 157.61 46.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.037 0.446 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.422 ' CG2' HG21 ' A' ' 17' ' ' VAL . 4.6 m -138.64 144.74 29.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.473 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.447 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 97.5 m -84.9 162.53 19.43 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.553 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.53 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 6.9 m-85 -144.75 96.41 2.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.127 0.489 . . . . 0.0 110.21 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' HB3' HD22 ' A' ' 58' ' ' LEU . 1.5 pttt -125.86 179.93 4.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.681 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.733 ' HB3' HD13 ' A' ' 36' ' ' ILE . 51.1 p90 -109.4 125.4 52.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.926 0.393 . . . . 0.0 111.301 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.84 101.04 12.83 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.02 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.12 -68.89 2.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.887 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.7 p -160.17 33.08 0.17 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.633 0.254 . . . . 0.0 111.231 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -149.91 131.06 14.47 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.733 HD13 ' HB3' ' A' ' 31' ' ' TYR . 37.6 mm -71.31 129.68 35.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.986 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.463 HG12 ' HB3' ' A' ' 9' ' ' ALA . 4.0 m -152.22 157.43 33.95 Favored Pre-proline 0 C--O 1.234 0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.111 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 29.4 Cg_endo -62.46 162.59 23.57 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.653 2.236 . . . . 0.0 112.499 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.447 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -138.22 -146.93 5.11 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.706 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.507 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 1.9 mp0 -30.3 133.88 0.06 Allowed 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.499 0.719 . . . . 0.0 112.895 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.55 ' NE2' HD22 ' A' ' 16' ' ' LEU . 6.7 tt0 -131.42 101.14 5.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.001 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -137.03 165.32 25.16 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.503 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.479 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.37 -12.13 33.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.254 0.222 . . . . 0.0 111.464 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -116.08 134.04 55.37 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.668 0.271 . . . . 0.0 110.542 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -69.96 -19.16 63.37 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.894 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -49.81 -40.12 40.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.651 0.262 . . . . 0.0 110.84 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -36.16 79.22 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.403 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' ALA . 42.2 t80 -64.78 -61.12 2.37 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 121.289 -0.164 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 40.6 mt -57.59 -30.77 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.159 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -47.0 85.8 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.905 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -99.57 -0.16 41.03 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -88.45 88.83 7.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.036 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.1 156.86 17.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.921 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.505 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.1 p-10 -80.48 62.44 4.58 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.512 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.775 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.2 t0 -161.62 43.45 0.15 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.314 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.775 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 169.86 153.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.722 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.7 127.3 52.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.327 179.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' A' ' 30' ' ' LYS . 13.4 mt -142.58 156.38 45.09 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.924 0.392 . . . . 0.0 111.671 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.53 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 78.9 m-85 -104.29 161.22 14.23 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.186 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.438 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -154.15 146.47 23.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.879 0.371 . . . . 0.0 111.505 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -128.56 110.7 12.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.523 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.688 HG22 ' CB ' ' A' ' 26' ' ' TRP . 18.2 t -125.93 131.13 72.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.889 0.376 . . . . 0.0 111.361 -179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.9 mtm-85 -88.3 151.48 22.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.692 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -127.83 158.98 36.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.2 t -142.63 129.27 20.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.732 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.8 p -119.29 88.9 3.02 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.839 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.53 175.3 37.28 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.75 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -159.94 79.38 0.69 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.078 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 41.47 40.61 1.35 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.359 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 ptt? -157.94 -39.31 0.07 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.433 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.5 m -155.4 87.47 1.11 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.749 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 110.18 15.5 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.949 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.9 mtp180 -110.47 111.86 23.4 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.101 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.6 t -84.2 144.65 28.81 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -143.3 157.0 44.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.62 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 6.4 m-85 -107.49 147.74 30.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.71 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.457 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -147.7 115.81 6.52 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.445 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 111' ' ' GLU . 5.6 tt -94.21 106.48 18.45 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.179 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.595 HG23 HD12 ' A' ' 114' ' ' ILE . 29.0 mm -94.67 120.95 44.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.285 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.481 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.1 OUTLIER -106.95 123.81 48.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.252 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.602 ' CZ3' HD23 ' A' ' 120' ' ' LEU . 40.9 t-105 -105.85 136.01 46.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.04 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.464 HG22 HG21 ' A' ' 86' ' ' VAL . 36.7 mt -137.6 93.36 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.505 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -64.38 112.28 4.86 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.573 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.407 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.6 mt-10 -24.72 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.719 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.3 m-80 -72.16 43.23 0.1 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.577 HG13 ' HB3' ' A' ' 90' ' ' GLN . 11.6 t -75.77 126.87 36.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.596 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.5 p -73.11 163.74 27.71 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.991 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.08 -38.77 39.96 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 121.215 -0.517 . . . . 0.0 113.084 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.6 mp -81.6 -40.52 22.88 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.577 ' HB3' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -58.01 -37.32 74.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.458 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -41.39 89.11 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.628 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.27 -38.54 78.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.753 179.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -52.87 -41.45 64.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.21 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.4 m -52.51 -46.78 66.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.376 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.7 -47.71 74.02 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.917 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.429 HG21 ' CB ' ' A' ' 2' ' ' ALA . 0.8 OUTLIER -63.42 -45.51 90.61 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.989 0.395 . . . . 0.0 111.008 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.448 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 78.6 m-20 -64.69 -39.21 93.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.318 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -57.27 -33.6 67.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.767 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 31.1 m -71.33 -48.7 48.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.557 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.687 ' O ' HG23 ' A' ' 104' ' ' VAL . 52.6 mt -56.04 -51.69 66.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 97' ' ' ASP . 44.1 t -60.81 -39.55 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.143 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -55.0 -41.92 71.86 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.999 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.84 -34.08 66.56 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.228 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 100' ' ' LEU . 33.8 t -67.64 -47.08 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.531 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 26.4 t -106.89 114.98 47.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -107.24 -29.08 9.53 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.283 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -93.83 88.0 5.61 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.737 0.303 . . . . 0.0 111.03 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -141.61 168.75 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.853 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -101.38 -53.87 2.9 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.456 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -150.34 147.44 27.61 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.605 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 78' ' ' LEU . 5.2 pt-20 -142.88 120.12 11.52 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.61 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -145.84 148.47 32.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.874 0.368 . . . . 0.0 111.262 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.481 HG12 ' HB ' ' A' ' 80' ' ' THR . 6.1 m -81.31 160.59 3.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.474 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.714 HD13 ' HA ' ' A' ' 120' ' ' LEU . 77.3 mt -141.09 132.86 28.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.103 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.5 m -116.61 -17.65 10.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.846 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.47 151.99 32.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.891 0.377 . . . . 0.0 111.176 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.492 ' HA ' ' CD2' ' A' ' 120' ' ' LEU . 32.1 ttp180 -64.2 -26.41 68.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.615 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 6.9 tptp -68.31 -38.06 81.21 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.993 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.67 ' CB ' HG23 ' A' ' 114' ' ' ILE . 1.2 mt-10 -73.4 -39.31 65.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.646 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.714 ' HA ' HD13 ' A' ' 114' ' ' ILE . 4.2 pp -74.77 -15.97 60.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.251 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -51.46 130.15 26.87 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.986 0.422 . . . . 0.0 110.697 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -48.05 -44.74 31.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.714 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -62.8 -41.31 99.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.939 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CZ ' ' HG2' ' A' ' 119' ' ' GLU . 32.9 t80 -59.47 -52.24 66.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.22 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.526 HG21 HD11 ' A' ' 79' ' ' ILE . 11.5 mt -55.21 -42.9 68.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -57.29 -40.99 78.92 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 32.6 t -69.27 -41.96 76.17 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.71 88.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.253 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.457 HD21 ' HB2' ' A' ' 77' ' ' ALA . 4.7 mp -71.05 -33.03 69.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.53 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -76.09 -48.88 19.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.326 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -69.11 0.55 Allowed 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.826 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 43.07 56.41 4.12 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 57.73 60.23 9.37 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.288 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.421 ' O ' ' HB2' ' A' ' 135' ' ' ALA . . . -65.96 -122.87 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.285 -0.483 . . . . 0.0 112.951 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 134' ' ' GLY . . . 177.36 27.27 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -132.47 13.99 4.53 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.919 0.39 . . . . 0.0 111.269 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -69.87 -43.98 70.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.219 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -74.69 149.75 39.77 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.042 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.485 ' HB1' HG22 ' A' ' 141' ' ' THR . . . -101.77 -32.9 10.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.33 15.48 9.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.884 0.373 . . . . 0.0 111.583 -179.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . 0.485 HG22 ' HB1' ' A' ' 139' ' ' ALA . 15.4 t -131.47 37.26 3.7 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.157 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.733 0.301 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.617 HG23 ' HE2' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -94.92 129.12 42.08 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.068 -179.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -136.52 145.04 44.62 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.531 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.526 HD12 HD11 ' A' ' 36' ' ' ILE . 13.9 tt -112.72 128.67 69.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 6.1 t0 -75.69 102.49 5.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.556 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -34.59 74.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.009 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -69.6 -50.12 47.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.898 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.517 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -62.46 -54.26 42.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.972 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.3 t -56.02 -37.09 68.71 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.813 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtm180 -60.04 -52.61 64.62 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.59 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -52.85 -48.77 66.82 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.126 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.545 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -58.27 -36.42 73.23 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.59 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.542 ' CE2' HG13 ' A' ' 105' ' ' VAL . 0.4 OUTLIER -60.86 -62.08 2.12 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.267 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -62.55 -33.44 74.94 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -60.94 -48.39 82.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.675 0.274 . . . . 0.0 110.819 179.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 13' ' ' ALA . 49.0 t -72.58 -30.66 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.46 -36.71 64.4 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.987 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.38 124.67 26.94 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.58 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -97.04 29.02 3.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -115.73 15.39 16.88 Favored Glycine 0 C--N 1.335 0.525 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.798 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 t -132.31 162.21 31.59 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.874 0.369 . . . . 0.0 110.972 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.72 58.35 2.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.054 0.454 . . . . 0.0 110.579 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.3 t -141.48 104.46 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.0 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.439 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -108.62 -26.37 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.563 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.424 ' HD1' HD11 ' A' ' 25' ' ' ILE . 26.8 p-90 -135.65 157.9 45.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.859 0.361 . . . . 0.0 111.333 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.572 HG22 ' HB3' ' A' ' 61' ' ' PHE . 27.0 m -140.99 150.06 20.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.268 179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.418 HG22 ' H ' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -97.47 174.71 6.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.967 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.418 ' H ' HG22 ' A' ' 28' ' ' THR . 2.3 m-85 -149.39 96.02 2.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.187 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.06 175.23 5.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.419 -179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.578 ' CE1' HG23 ' A' ' 36' ' ' ILE . 0.8 OUTLIER -104.18 120.7 41.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.912 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -102.54 89.82 3.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.201 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.63 -79.62 1.38 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.146 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.25 32.06 1.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.786 0.327 . . . . 0.0 111.21 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.6 t -154.36 148.87 26.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.663 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.578 HG23 ' CE1' ' A' ' 31' ' ' TYR . 5.7 pt -90.04 135.36 26.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.952 0.406 . . . . 0.0 111.232 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.502 HG13 ' CB ' ' A' ' 9' ' ' ALA . 44.6 t -141.98 139.35 18.01 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.602 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.517 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 9.9 Cg_endo -51.07 153.16 9.48 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.61 2.207 . . . . 0.0 112.248 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -126.17 -152.96 8.25 Favored Glycine 0 N--CA 1.442 -0.966 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.653 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.0 mp0 -34.05 139.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.562 0.745 . . . . 0.0 112.682 -179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' HG2' HG12 ' A' ' 27' ' ' VAL . 11.7 mt-30 -134.42 94.64 3.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.217 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.08 165.58 21.79 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.782 -0.723 . . . . 0.0 113.301 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.439 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -90.59 -19.94 23.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.587 0.232 . . . . 0.0 110.962 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.72 126.24 38.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.766 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.462 ' HD2' HD11 ' A' ' 49' ' ' ILE . 42.5 t80 -74.03 -16.64 61.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.889 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -51.33 -41.01 60.27 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.657 0.265 . . . . 0.0 111.043 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.01 -29.48 67.66 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.239 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.609 ' HE2' ' HB1' ' A' ' 60' ' ' ALA . 32.4 t80 -63.37 -45.36 91.53 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.716 0.293 . . . . 0.0 110.825 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.462 HD11 ' HD2' ' A' ' 45' ' ' TYR . 3.5 mt -69.13 -42.96 81.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.093 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -55.39 -47.08 76.4 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.483 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -75.94 -33.77 59.84 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.479 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -72.83 81.05 1.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.849 0.357 . . . . 0.0 111.332 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.3 p -107.45 144.92 33.7 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.565 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -74.05 65.85 1.15 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.347 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.799 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -157.83 38.86 0.27 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.417 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.799 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 161.95 163.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.252 0.621 . . . . 0.0 110.365 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.726 ' HB3' HG11 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -107.98 124.65 50.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.47 179.057 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 pp -147.94 145.28 28.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.089 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 97' ' ' ASP . 3.4 m-85 -90.59 166.59 13.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.609 ' HB1' ' HE2' ' A' ' 48' ' ' PHE . . . -153.78 172.33 17.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.134 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.572 ' HB3' HG22 ' A' ' 27' ' ' VAL . 1.5 t80 -152.31 138.47 18.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.2 t -143.52 137.65 25.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.003 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -102.86 127.64 49.97 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.662 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -117.04 159.19 22.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.902 0.382 . . . . 0.0 111.332 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.8 t -142.15 134.68 28.11 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.711 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 42.3 p -124.59 87.82 2.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.948 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.448 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.44 163.2 33.86 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.84 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -160.1 79.42 0.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.889 0.376 . . . . 0.0 111.143 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.79 33.61 1.58 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.352 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.6 ptp -151.37 -36.48 0.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.339 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.1 t -159.02 83.01 0.79 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.448 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -79.8 115.8 19.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.71 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.1 155.11 47.52 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.25 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -125.26 141.75 51.9 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -141.19 129.14 21.88 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.97 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.552 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 70.3 m-85 -85.3 141.1 30.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.66 114.13 17.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.732 HD11 HG11 ' A' ' 101' ' ' VAL . 0.5 OUTLIER -94.96 106.46 18.45 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.542 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.444 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 25.6 mm -103.15 115.22 44.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.438 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.459 HG21 HG22 ' A' ' 113' ' ' VAL . 5.2 t -109.16 110.66 21.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.324 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -86.5 140.08 30.27 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.11 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.509 HG23 ' HB3' ' A' ' 115' ' ' SER . 2.7 tt -128.16 84.57 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.352 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.508 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -67.62 116.95 8.3 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.889 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 86' ' ' VAL . 4.0 mm-40 -33.54 -31.68 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.751 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.5 m-80 -73.58 36.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.454 0.57 . . . . 0.0 111.727 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.726 HG11 ' HB3' ' A' ' 57' ' ' ARG . 3.7 m -102.04 113.32 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 70.9 m -65.52 174.28 2.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.952 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -49.18 -45.99 34.37 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.933 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -47.81 80.58 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.674 0.273 . . . . 0.0 110.982 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -63.2 -37.72 88.33 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.106 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -50.66 71.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.775 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.96 72.0 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.542 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.617 ' HE2' HG23 ' A' ' 3' ' ' THR . 0.3 OUTLIER -56.57 -36.87 69.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.248 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.3 -47.5 85.17 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.832 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.85 -46.55 93.89 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.016 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.649 ' O ' HG22 ' A' ' 99' ' ' THR . 4.0 m -63.81 -33.12 74.96 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.784 0.326 . . . . 0.0 110.722 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.553 ' O ' HG23 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -69.78 -31.18 68.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.383 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -34.29 74.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.678 0.275 . . . . 0.0 110.897 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.649 HG22 ' O ' ' A' ' 96' ' ' THR . 7.4 t -83.68 -33.24 25.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.276 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 97' ' ' ASP . 21.1 mt -68.08 -47.76 67.38 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.809 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.732 HG11 HD11 ' A' ' 78' ' ' LEU . 37.9 t -68.74 -38.02 78.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.366 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -63.23 -39.46 94.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.704 0.287 . . . . 0.0 110.656 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -65.35 -50.61 64.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.971 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.868 HG13 HG23 ' A' ' 105' ' ' VAL . 14.9 p -71.22 -36.26 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.337 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.868 HG23 HG13 ' A' ' 104' ' ' VAL . 26.1 t -118.15 98.94 7.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.937 0.399 . . . . 0.0 110.837 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -100.95 -36.84 8.89 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.008 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -78.15 81.22 4.54 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 110.74 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 17.0 p90 -130.18 177.07 7.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.698 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -110.07 -52.58 2.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.112 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -154.95 143.77 20.78 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.894 0.378 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.528 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 13.4 pt-20 -148.06 126.53 12.39 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.529 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -143.79 168.01 20.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.39 . . . . 0.0 111.434 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.459 HG22 HG21 ' A' ' 80' ' ' THR . 4.7 t -107.09 130.08 59.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.466 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.632 HG22 ' H ' ' A' ' 116' ' ' ASP . 41.4 mm -127.51 148.27 32.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.132 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.509 ' HB3' HG23 ' A' ' 82' ' ' ILE . 47.7 p -138.14 30.94 2.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.992 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.632 ' H ' HG22 ' A' ' 114' ' ' ILE . 26.2 t70 -136.29 135.01 38.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.682 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -37.11 85.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.373 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.5 tttm -63.04 -47.68 81.99 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.479 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -69.71 -30.14 67.71 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.853 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -33.12 74.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.765 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -47.46 131.76 13.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.206 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -51.73 -32.63 31.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.884 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -58.19 -45.18 88.01 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.851 0.358 . . . . 0.0 110.374 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -67.28 -47.34 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.012 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.87 -47.95 89.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -62.18 -41.76 98.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -45.44 93.26 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.727 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -63.45 -49.78 72.32 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.52 -37.1 82.5 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.099 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -57.86 -39.53 77.97 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.948 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -60.49 -28.99 68.8 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.313 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -102.13 34.85 2.57 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.403 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -63.13 -23.71 66.38 Favored Glycine 0 C--N 1.334 0.438 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.369 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -127.95 -134.16 3.85 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.089 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -141.24 29.51 1.81 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.56 0.219 . . . . 0.0 111.448 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 51.42 35.94 15.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 111.416 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -83.82 -44.7 14.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.06 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -77.26 148.8 35.57 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.203 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -160.71 -64.07 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -136.37 17.16 3.17 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.631 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.6 p -100.21 49.41 0.91 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.83 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.91 179.72 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.666 0.27 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -123.51 84.0 2.21 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.445 ' O ' HD12 ' A' ' 36' ' ' ILE . 21.3 mttm -104.08 176.79 5.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.514 HD13 ' HA ' ' A' ' 101' ' ' VAL . 10.0 tt -118.16 123.84 72.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.7 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.468 ' HB3' HG12 ' A' ' 37' ' ' VAL . 7.3 t70 -67.4 111.01 3.82 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.424 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -45.36 88.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.33 -44.48 75.9 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.062 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.617 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.49 -54.9 29.03 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -58.19 -47.78 82.38 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.092 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -42.02 99.14 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.895 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.41 -49.42 74.56 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.837 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.447 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.79 -32.9 74.69 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.175 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -57.64 10.41 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.146 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -68.5 -31.32 70.49 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.572 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.5 -49.11 64.96 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.141 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 13' ' ' ALA . 59.2 t -71.0 -33.82 53.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.833 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -53.88 -35.58 61.73 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.988 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -67.94 126.76 30.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.259 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -97.14 40.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.244 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -139.8 32.11 2.24 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.948 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -138.9 26.98 2.44 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.863 0.331 . . . . 0.0 111.781 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . 48.29 32.1 3.0 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.426 HG23 ' HB2' ' A' ' 41' ' ' GLN . 12.5 p -111.45 131.69 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.777 0.322 . . . . 0.0 111.634 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.543 HG12 ' HA ' ' A' ' 43' ' ' ALA . 18.0 pt -129.48 -41.55 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.638 ' CB ' HG22 ' A' ' 62' ' ' VAL . 27.9 p-90 -121.69 159.84 25.72 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.965 0.412 . . . . 0.0 111.802 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.61 HG12 ' HB3' ' A' ' 41' ' ' GLN . 12.4 m -142.84 148.08 20.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.588 178.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.612 HG22 ' HZ3' ' A' ' 26' ' ' TRP . 1.5 t -120.05 115.46 23.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.477 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 9.3 m-85 -79.64 121.1 24.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.607 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.71 164.75 17.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.87 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -78.66 113.26 16.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.899 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -132.42 108.93 9.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.664 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.54 37.63 58.11 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.521 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 m 64.38 26.85 13.62 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.706 0.288 . . . . 0.0 111.198 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 t -146.47 153.32 40.3 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.939 0.399 . . . . 0.0 110.735 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.445 HD12 ' O ' ' A' ' 4' ' ' LYS . 3.0 mp -84.08 128.88 38.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.468 HG12 ' HB3' ' A' ' 6' ' ' ASP . 19.6 m -145.11 144.92 25.16 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.884 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.617 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 36.5 Cg_exo -57.26 149.46 64.2 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -130.35 -153.47 7.73 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 121.21 -0.519 . . . . 0.0 112.467 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.581 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 8.9 mp0 -23.96 132.64 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.791 0.836 . . . . 0.0 112.74 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.61 ' HB3' HG12 ' A' ' 27' ' ' VAL . 1.7 pt20 -134.13 98.86 4.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.158 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.77 164.69 25.18 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.467 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 23' ' ' ALA . . . -88.34 -21.12 24.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.609 0.242 . . . . 0.0 110.805 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.12 115.36 28.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.729 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -68.35 -17.69 64.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.407 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.47 -40.84 27.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.664 0.269 . . . . 0.0 110.695 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -37.48 87.56 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.999 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.626 ' HZ ' ' HB2' ' A' ' 60' ' ' ALA . 5.8 t80 -67.84 -39.57 83.82 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.06 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 53.7 mt -68.46 -48.09 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.992 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.97 -36.19 76.6 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.685 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.37 -24.61 27.49 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.528 ' SG ' HD21 ' A' ' 120' ' ' LEU . 1.3 m -74.66 82.39 2.05 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.829 0.347 . . . . 0.0 111.456 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.2 p -92.19 171.64 8.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.259 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.453 ' HB3' ' HG3' ' A' ' 84' ' ' GLU . 7.6 m-20 -86.27 19.06 2.85 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.563 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.694 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -134.79 71.95 1.45 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.674 0.273 . . . . 0.0 110.564 -179.717 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.694 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -174.66 -172.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 120.939 0.399 . . . . 0.0 111.533 -179.363 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.79 102.67 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.18 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -149.53 177.64 9.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.528 ' CD1' HG23 ' A' ' 80' ' ' THR . 28.0 m-85 -110.36 171.79 7.25 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.626 ' HB2' ' HZ ' ' A' ' 48' ' ' PHE . . . -151.26 164.17 37.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.394 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 78' ' ' LEU . 2.9 t80 -153.82 108.89 3.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.828 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.638 HG22 ' CB ' ' A' ' 26' ' ' TRP . 13.0 t -119.38 139.28 47.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.338 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -93.47 105.12 17.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.454 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.529 ' CG ' HD22 ' A' ' 129' ' ' LEU . 23.7 m-85 -84.69 141.84 30.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.182 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -126.5 121.6 32.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.756 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.405 HG21 ' HG3' ' A' ' 130' ' ' LYS . 34.7 p -121.04 100.84 7.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.573 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.599 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -159.94 148.97 18.2 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.172 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.474 ' C ' ' H ' ' A' ' 70' ' ' MET . 0.6 OUTLIER -99.29 -177.82 3.72 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.538 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.1 14.53 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.474 ' H ' ' C ' ' A' ' 68' ' ' ASP . 22.4 ptp -120.18 -34.95 3.55 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.486 0.315 . . . . 0.0 111.236 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 m -155.05 147.13 23.66 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 120.642 0.258 . . . . 0.0 110.982 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.599 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 3.5 pttm -124.97 142.59 51.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -137.17 144.23 42.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.74 149.61 31.42 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.122 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.3 mtmm -138.88 139.54 38.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.753 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -104.77 123.57 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.878 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.633 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -136.64 136.01 38.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.15 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.429 HD21 ' HB3' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -107.33 106.59 17.1 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.379 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.413 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 2.0 mt -90.58 121.87 41.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.16 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.528 HG23 ' CD1' ' A' ' 59' ' ' PHE . 1.7 m -96.29 123.47 39.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.36 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.697 ' CE3' HD22 ' A' ' 120' ' ' LEU . 68.8 t-105 -111.13 134.38 52.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.891 0.377 . . . . 0.0 111.022 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 39.9 mt -137.75 105.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.031 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -68.84 116.57 7.42 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.624 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' HB3' ' A' ' 54' ' ' ASP . 0.1 OUTLIER -38.12 -30.34 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.657 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.2 m-80 -72.94 36.24 0.08 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.031 0.444 . . . . 0.0 111.966 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.451 ' H ' ' C ' ' A' ' 84' ' ' GLU . 5.0 m -109.35 127.73 65.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.546 178.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.99 170.45 11.27 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.85 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -51.03 -42.17 47.38 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.672 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.4 -44.99 93.06 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.854 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -61.69 -41.73 97.97 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.878 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -61.23 -46.06 91.96 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.649 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.24 78.06 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.255 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -55.62 -55.05 36.56 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.856 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -38.55 71.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.58 -45.74 94.2 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.823 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.8 -45.37 36.43 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.668 0.234 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.887 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -59.76 -38.34 81.54 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.297 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -32.73 69.6 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.871 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.1 m -70.53 -42.73 70.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.441 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.887 HD12 ' HA ' ' A' ' 97' ' ' ASP . 6.4 mt -61.8 -50.07 73.81 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.084 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.514 ' HA ' HD13 ' A' ' 5' ' ' ILE . 13.0 p -62.65 -35.39 70.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.274 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmtt? -62.79 -41.79 99.43 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.714 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -62.83 -37.73 87.94 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.845 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 100' ' ' LEU . 39.7 t -63.79 -44.89 98.37 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.924 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -121.38 98.55 6.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -95.0 -24.85 16.74 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.555 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -80.16 83.65 5.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.787 0.327 . . . . 0.0 110.89 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -136.23 166.96 22.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.61 -55.35 2.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.318 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -132.74 147.65 52.32 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.288 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.429 ' HB3' HD21 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -152.0 124.58 8.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.992 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.611 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 13.4 p90 -158.55 161.1 37.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.382 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.455 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 8.7 p -109.31 140.39 28.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.781 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.587 HD11 ' HE1' ' A' ' 112' ' ' PHE . 8.5 mt -131.87 139.37 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 111.337 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.68 -26.24 10.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.947 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -83.9 138.67 33.05 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -35.64 81.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.525 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -68.19 -47.45 67.88 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.34 -27.9 68.25 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.204 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.697 HD22 ' CE3' ' A' ' 81' ' ' TRP . 1.3 tp -76.37 -28.48 56.79 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.6 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -50.59 135.17 23.39 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.102 0.477 . . . . 0.0 111.164 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.45 -31.65 46.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.121 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.38 -43.79 92.85 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.802 0.334 . . . . 0.0 110.599 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -66.38 -48.91 68.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.905 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.611 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 15.8 mt -61.96 -37.4 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.25 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.78 -40.49 63.24 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.5 t -73.08 -43.02 62.39 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -63.31 -49.41 74.1 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.185 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.633 HD11 ' CB ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -62.51 -45.47 92.85 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.271 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.405 ' HG3' HG21 ' A' ' 66' ' ' THR . 43.2 tttt -65.12 -33.21 75.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.889 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -54.18 -45.27 72.08 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.137 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.15 44.43 29.19 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.055 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.84 49.05 6.69 Favored Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.449 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -77.91 70.16 2.56 Favored Glycine 0 C--N 1.336 0.577 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.355 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -171.92 26.05 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -163.8 26.67 0.08 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.723 0.297 . . . . 0.0 111.082 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -55.69 -42.81 75.75 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.653 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -76.73 151.17 36.15 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.889 0.376 . . . . 0.0 111.267 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -152.87 -64.47 0.16 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.115 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -145.82 18.68 1.46 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.882 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 12.1 t -89.43 -42.04 11.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.409 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.034 -179.741 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.767 0.318 . . . . 0.0 111.316 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 m -132.74 113.81 13.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.577 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -103.78 157.61 16.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.487 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.459 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.1 tt -128.73 118.83 48.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.471 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -79.97 112.01 16.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.918 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -37.41 58.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -55.37 35.56 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.099 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.679 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -59.53 -49.61 77.11 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.141 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.81 -46.88 84.05 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.899 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.8 mtt-85 -62.35 -46.31 89.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.926 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.16 -45.25 79.74 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.796 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -63.07 -46.52 87.06 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -56.3 -42.24 77.24 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -59.5 -44.57 93.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.908 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.413 ' HA ' HD22 ' A' ' 16' ' ' LEU . 0.3 OUTLIER -65.13 -43.35 92.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.077 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.588 HG21 HG21 ' A' ' 27' ' ' VAL . 26.3 t -71.38 -31.05 42.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.259 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -39.38 58.91 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.929 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -87.09 134.18 33.53 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.608 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -98.99 27.1 5.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.306 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.42 31.42 5.06 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.016 -0.612 . . . . 0.0 112.395 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.57 ' O ' HG23 ' A' ' 24' ' ' VAL . 4.9 t -133.79 23.89 3.96 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 53.9 29.31 9.68 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 22' ' ' SER . 23.6 t -114.46 132.16 64.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.746 0.308 . . . . 0.0 111.391 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.59 HG12 ' HA ' ' A' ' 43' ' ' ALA . 22.8 pt -129.67 -40.68 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.609 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.774 ' HB2' HG22 ' A' ' 62' ' ' VAL . 24.6 p-90 -123.74 154.24 39.76 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.879 0.371 . . . . 0.0 111.294 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.739 HG13 ' HG3' ' A' ' 41' ' ' GLN . 6.8 t -138.57 155.05 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.198 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.43 ' O ' ' N ' ' A' ' 39' ' ' GLY . 0.3 OUTLIER -98.63 169.91 9.17 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.545 179.246 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -150.91 95.87 2.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.995 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -122.01 170.03 10.24 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.969 0.414 . . . . 0.0 111.61 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -80.21 135.87 36.36 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.759 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.524 ' HB2' ' CG2' ' A' ' 37' ' ' VAL . 5.0 m-20 -153.7 116.52 4.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.09 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.83 40.29 75.22 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.928 -0.654 . . . . 0.0 113.014 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 m 62.78 28.42 16.47 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.626 0.251 . . . . 0.0 111.494 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.5 t -156.0 149.1 24.39 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 5.6 mt -78.39 132.24 32.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.171 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.524 ' CG2' ' HB2' ' A' ' 32' ' ' ASP . 30.9 m -144.47 154.09 56.18 Favored Pre-proline 0 CA--C 1.531 0.217 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.679 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 36.5 Cg_endo -64.85 163.45 28.03 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.429 2.086 . . . . 0.0 112.306 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.18 -153.84 7.69 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.253 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.442 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.6 mp0 -36.13 141.74 0.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.739 ' HG3' HG13 ' A' ' 27' ' ' VAL . 8.1 mt-30 -135.71 111.71 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.85 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.75 168.11 34.85 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.543 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.59 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.08 -18.73 29.83 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.723 -0.239 . . . . 0.0 110.956 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.71 119.94 31.35 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.752 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.414 ' HD2' HD11 ' A' ' 49' ' ' ILE . 15.2 t80 -72.94 -23.11 60.64 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.611 ' HA ' HD12 ' A' ' 49' ' ' ILE . 15.8 tp60 -48.76 -37.33 18.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.637 0.256 . . . . 0.0 110.715 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.14 -33.65 76.51 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.337 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.87 -42.54 63.57 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.687 0.28 . . . . 0.0 111.057 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 46' ' ' GLN . 9.6 mt -62.31 -40.55 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.137 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -69.2 -38.35 78.57 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.552 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.97 -42.73 60.04 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.44 -179.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 6.1 m -80.45 84.22 6.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.979 0.419 . . . . 0.0 111.803 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 p -96.89 161.8 13.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.551 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.489 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 1.5 m-20 -81.89 63.39 6.11 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.123 0.487 . . . . 0.0 111.299 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.744 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.8 t70 -170.08 43.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.741 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.744 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.1 150.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.525 -179.514 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.583 ' HD3' HG23 ' A' ' 94' ' ' THR . 0.0 OUTLIER -109.9 121.82 46.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.731 179.549 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.6 173.38 11.87 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -117.85 172.3 7.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.256 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.37 166.08 31.89 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.47 . . . . 0.0 111.667 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -144.77 112.21 6.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.824 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.774 HG22 ' HB2' ' A' ' 26' ' ' TRP . 17.5 t -126.14 137.14 58.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.932 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -119.45 124.95 47.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.59 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -111.99 161.8 16.05 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.266 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 m -139.3 113.69 8.99 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.375 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.3 t -121.88 146.05 47.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.067 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.4 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -148.31 169.43 28.96 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.135 -0.555 . . . . 0.0 112.542 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -114.69 79.06 1.22 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.899 0.38 . . . . 0.0 111.331 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 30.4 48.22 0.05 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 179.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 15.2 ptp -178.95 -35.42 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.679 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -148.33 123.56 10.2 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.782 0.325 . . . . 0.0 111.173 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.4 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -107.87 129.99 55.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.452 179.488 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -118.6 138.3 52.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.713 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.6 t -102.41 150.4 23.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -148.16 138.42 22.72 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.947 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -94.07 147.08 23.48 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.552 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.54 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -143.53 142.04 30.97 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.596 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.93 105.15 16.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.389 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 25.4 mm -93.16 113.05 27.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.199 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.463 ' HB ' HG22 ' A' ' 113' ' ' VAL . 15.3 m -98.77 114.15 26.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.608 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -100.35 137.73 38.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.857 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.527 ' CG2' HG21 ' A' ' 86' ' ' VAL . 40.0 mt -138.57 97.37 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.489 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -66.95 109.7 3.06 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.382 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 86' ' ' VAL . 36.9 mt-10 -22.23 -46.34 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 -179.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.736 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.2 m-80 -70.72 43.68 0.07 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.14 0.495 . . . . 0.0 111.935 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.527 HG21 ' CG2' ' A' ' 82' ' ' ILE . 4.1 t -78.61 145.51 9.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.277 178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.0 m -83.71 171.28 13.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.02 7.08 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.409 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mp -58.97 -37.3 76.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.72 0.295 . . . . 0.0 110.964 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.69 -34.88 77.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -30.42 71.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.538 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -85.07 -39.0 18.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.975 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.0 -33.82 67.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.302 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.583 HG23 ' HD3' ' A' ' 57' ' ' ARG . 3.0 p -64.62 -42.09 95.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.543 0.211 . . . . 0.0 110.736 179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.48 -49.44 76.65 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.12 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -73.64 -30.2 62.8 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 111.505 0.187 . . . . 0.0 111.505 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.646 ' HA ' HD12 ' A' ' 100' ' ' LEU . 9.9 t0 -58.69 -42.73 89.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.7 0.286 . . . . 0.0 111.039 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? -53.77 -32.73 53.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.128 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 79.9 m -74.98 -41.5 59.41 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.006 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 97' ' ' ASP . 16.8 mt -61.66 -49.23 77.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.364 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.501 ' HA ' HG12 ' A' ' 104' ' ' VAL . 58.6 t -64.65 -37.65 80.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.911 179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.8 tttp -61.85 -34.96 76.92 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.042 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -75.18 -47.5 28.03 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.442 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.793 HG13 HG23 ' A' ' 105' ' ' VAL . 13.7 p -66.54 -38.32 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.499 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.793 HG23 HG13 ' A' ' 104' ' ' VAL . 43.7 t -127.8 121.5 56.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 120.772 0.32 . . . . 0.0 110.967 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -120.17 3.29 10.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.961 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -89.43 74.55 7.75 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.913 0.387 . . . . 0.0 111.073 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -145.8 147.69 32.13 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.148 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.82 -41.85 15.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.372 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.55 ' HD2' HD22 ' A' ' 129' ' ' LEU . 0.1 OUTLIER -152.28 160.47 43.34 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.813 0.339 . . . . 0.0 111.181 -179.776 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -150.6 122.64 8.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.892 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -137.47 166.22 24.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 111.123 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.463 HG22 ' HB ' ' A' ' 80' ' ' THR . 25.5 t -110.37 139.57 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.631 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.527 HG22 ' H ' ' A' ' 116' ' ' ASP . 32.7 mm -131.53 151.1 34.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.105 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 5.1 t -147.1 29.8 0.97 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.017 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.527 ' H ' HG22 ' A' ' 114' ' ' ILE . 35.4 t70 -137.52 136.08 37.33 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.58 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.89 -35.91 82.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.289 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.8 tttm -65.9 -41.87 90.96 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.46 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -73.49 -33.11 64.66 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.59 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.428 ' HA ' HD23 ' A' ' 120' ' ' LEU . 5.0 mt -61.02 -34.15 74.39 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.432 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -43.43 130.31 5.03 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.333 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -49.69 -36.87 26.64 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.922 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -60.58 -42.6 97.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.893 0.378 . . . . 0.0 110.22 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -69.77 -49.71 50.37 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.952 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.4 mm -55.98 -46.51 80.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.068 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -66.81 -34.7 78.38 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.172 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.3 t -61.97 -48.81 78.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.828 0.347 . . . . 0.0 110.255 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.35 -32.21 71.15 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.712 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.55 HD22 ' HD2' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -53.44 -47.47 69.64 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.644 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -44.55 70.27 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.591 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.48 -43.32 77.18 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.735 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.416 ' HA ' ' CE2' ' A' ' 137' ' ' TYR . . . -73.47 89.36 1.66 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 111.183 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 97.16 39.32 4.05 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.54 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 135' ' ' ALA . . . -112.94 -86.93 1.59 Allowed Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.472 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 134' ' ' GLY . . . 176.07 32.06 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 120.621 0.248 . . . . 0.0 111.578 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -167.85 30.32 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 110.835 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.416 ' CE2' ' HA ' ' A' ' 132' ' ' ALA . 3.0 t80 -48.5 -39.41 23.1 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.832 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.76 155.98 39.84 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.807 0.337 . . . . 0.0 110.857 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -161.57 29.59 0.13 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -111.1 11.74 21.96 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.936 0.398 . . . . 0.0 111.384 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.2 p -146.33 38.15 1.04 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.775 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.798 0.332 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -133.99 130.89 38.27 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.735 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -107.98 103.22 12.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.69 HD12 ' HB ' ' A' ' 36' ' ' ILE . 0.9 OUTLIER -80.01 113.37 19.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.556 179.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.419 ' HB3' HG12 ' A' ' 37' ' ' VAL . 16.7 t0 -72.02 106.79 4.42 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HD3' HG23 ' A' ' 104' ' ' VAL . 1.3 mmmp? -68.26 -40.3 81.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.676 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -60.98 -45.95 92.73 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.752 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -59.65 -57.05 14.61 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.633 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 46.3 t -57.17 -42.83 81.84 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -41.99 96.27 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.906 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.76 -52.85 58.89 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.926 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.457 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -65.43 -33.46 76.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.158 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.526 ' HE2' HG13 ' A' ' 105' ' ' VAL . 1.2 t80 -55.96 -57.13 13.4 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.334 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -69.9 -29.81 67.09 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.618 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.46 -48.51 79.3 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.645 0.26 . . . . 0.0 111.128 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 13' ' ' ALA . 47.7 t -69.4 -33.74 58.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.45 -18.3 60.66 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.823 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -73.38 70.1 1.2 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 111.249 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.3 18.61 3.46 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.611 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 51.83 69.08 1.26 Allowed Glycine 0 C--N 1.339 0.736 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.465 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.464 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.5 t -71.53 78.4 0.79 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.901 0.381 . . . . 0.0 111.312 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 57.18 28.13 14.59 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.914 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 22' ' ' SER . 48.2 t -141.33 109.42 2.45 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.746 0.308 . . . . 0.0 110.849 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.41 HG12 ' HA ' ' A' ' 43' ' ' ALA . 2.2 pt -108.18 -28.84 2.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.542 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.563 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 43.9 p-90 -128.71 158.15 39.38 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.891 0.377 . . . . 0.0 111.312 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.619 HG12 ' HG2' ' A' ' 41' ' ' GLN . 29.2 m -142.34 143.99 25.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.154 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.561 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 3.6 m -82.38 168.09 17.86 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.472 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.452 ' CB ' ' HB2' ' A' ' 59' ' ' PHE . 7.7 m-85 -147.46 108.9 4.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 110.496 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -143.88 148.87 36.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 35' ' ' THR . 43.7 p90 -98.18 133.69 42.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.569 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -104.35 108.44 19.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.211 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.0 -71.37 2.21 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.123 -179.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 p -159.8 33.71 0.18 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.205 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 3.3 t -145.47 126.39 14.49 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.69 ' HB ' HD12 ' A' ' 5' ' ' ILE . 33.3 mt -83.94 133.28 29.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.419 HG12 ' HB3' ' A' ' 6' ' ' ASP . 15.3 m -152.98 156.28 32.64 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.201 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.752 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.4 Cg_endo -65.86 160.05 45.88 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.6 2.2 . . . . 0.0 112.242 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.561 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -129.69 -146.67 6.09 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.494 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.563 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -36.29 137.32 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.083 0.553 . . . . 0.0 112.412 -179.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.619 ' HG2' HG12 ' A' ' 27' ' ' VAL . 14.3 mt-30 -135.22 114.44 12.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.329 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -149.99 160.94 28.72 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.757 -0.735 . . . . 0.0 113.338 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.41 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -81.12 -25.92 36.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.571 0.224 . . . . 0.0 110.815 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.42 121.37 38.15 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.511 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -68.92 -20.4 64.23 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -37.15 9.61 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.748 0.309 . . . . 0.0 111.042 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -42.96 99.48 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.678 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 56.4 t80 -66.88 -45.28 78.54 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.719 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 55.0 mt -61.42 -36.14 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -59.5 -47.06 86.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.016 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.88 -17.33 47.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.853 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.657 ' SG ' HD21 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -70.86 83.51 0.65 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.115 0.483 . . . . 0.0 111.592 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.2 p -111.09 146.21 37.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.458 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.516 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 2.3 m-20 -78.96 59.94 2.77 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.84 0.352 . . . . 0.0 111.699 -179.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.747 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.6 t70 -157.85 36.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.989 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.747 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -179.36 174.17 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.022 -179.759 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.569 ' HG2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -124.77 133.76 53.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.928 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.39 164.03 32.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.988 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.452 ' HB2' ' CB ' ' A' ' 29' ' ' PHE . 18.9 m-85 -105.87 166.19 10.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.925 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.678 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -143.87 155.52 44.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.578 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.449 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 1.2 t80 -152.07 135.53 16.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.503 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.21 141.93 12.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.855 0.36 . . . . 0.0 111.308 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD2' ' CE2' ' A' ' 76' ' ' PHE . 11.0 ttp180 -108.9 154.44 22.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.612 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.462 ' CD1' HD22 ' A' ' 129' ' ' LEU . 71.9 m-85 -125.47 150.47 47.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.1 m -146.8 99.98 3.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.656 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.6 p -105.21 91.26 3.72 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.925 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.477 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.31 161.7 32.74 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.823 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -158.83 79.94 0.78 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.98 0.419 . . . . 0.0 111.237 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.41 36.92 1.79 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.215 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.0 ptm -155.03 -37.27 0.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.399 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.3 m -157.88 82.88 0.87 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.552 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.477 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.4 OUTLIER -79.78 100.48 7.97 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.598 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -113.45 125.3 54.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -109.66 146.26 35.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.67 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -139.83 143.63 36.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.156 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.48 ' CE2' ' HD2' ' A' ' 63' ' ' ARG . 5.5 m-85 -119.18 136.14 54.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.714 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -142.55 140.76 31.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.962 0.411 . . . . 0.0 111.718 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HG ' ' CD2' ' A' ' 61' ' ' PHE . 1.2 tt -109.15 119.66 40.2 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.241 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.451 ' O ' ' HB3' ' A' ' 60' ' ' ALA . 2.2 mp -113.33 127.88 70.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 0.0 111.363 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.631 ' HB ' HG23 ' A' ' 113' ' ' VAL . 1.1 m -102.82 132.68 48.83 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.236 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.714 ' CE3' HD22 ' A' ' 120' ' ' LEU . 55.3 t-105 -109.36 123.96 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.902 0.382 . . . . 0.0 111.421 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.557 HD11 ' HD3' ' A' ' 91' ' ' ARG . 1.9 tt -114.91 100.32 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.861 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.516 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -71.35 73.2 0.75 Allowed Glycine 0 C--N 1.333 0.368 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.932 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 24.11 -75.22 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.508 ' N ' ' O ' ' A' ' 83' ' ' GLY . 49.5 m-80 -49.0 -18.06 0.26 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.548 HG21 HG13 ' A' ' 82' ' ' ILE . 16.7 t -36.75 109.24 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 O-C-N 123.229 0.33 . . . . 0.0 111.608 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.8 m -61.3 168.81 2.47 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.676 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -59.07 -48.25 86.83 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.467 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 89' ' ' LEU . 10.3 tp -57.34 -38.9 74.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.695 0.283 . . . . 0.0 110.533 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.569 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 24.5 mm-40 -68.73 -37.83 79.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.399 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.557 ' HD3' HD11 ' A' ' 82' ' ' ILE . 1.3 mmm180 -59.47 -51.45 69.84 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.431 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.53 87.71 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.94 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.98 -46.0 82.51 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.461 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 63.2 m -60.99 -44.46 97.37 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.72 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.22 -52.39 49.8 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.703 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.38 -37.43 85.26 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.59 0.233 . . . . 0.0 110.938 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.667 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.1 m-20 -57.91 -40.86 81.4 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.945 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -62.46 -29.75 70.75 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.015 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.6 m -67.79 -47.24 69.66 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.722 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' A' ' 97' ' ' ASP . 1.4 mt -61.98 -42.54 99.25 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.965 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 97' ' ' ASP . 41.0 t -67.96 -31.68 53.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -64.78 -41.12 96.09 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.932 179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.45 -52.68 43.78 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.13 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.785 HG13 HG23 ' A' ' 105' ' ' VAL . 7.6 p -64.29 -34.27 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.3 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.785 HG23 HG13 ' A' ' 104' ' ' VAL . 41.1 t -119.29 89.92 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 120.912 0.387 . . . . 0.0 110.713 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -101.52 -24.37 14.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.585 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -77.63 84.17 4.0 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.923 0.392 . . . . 0.0 110.841 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.423 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 21.6 p90 -146.04 164.17 32.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.872 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.52 -47.7 8.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.169 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -165.18 161.86 19.67 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.135 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -150.6 138.89 20.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.789 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -147.0 168.52 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.978 0.418 . . . . 0.0 111.288 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.631 HG23 ' HB ' ' A' ' 80' ' ' THR . 8.8 p -119.15 139.33 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 113' ' ' VAL . 38.9 mm -129.69 151.96 36.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.987 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 14.9 m -109.94 -29.28 8.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.244 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -101.42 149.64 23.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.812 0.339 . . . . 0.0 110.872 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -69.44 -21.28 63.74 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.884 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -61.79 -57.74 10.68 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.634 0.254 . . . . 0.0 111.114 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -75.19 -22.34 58.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.582 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.714 HD22 ' CE3' ' A' ' 81' ' ' TRP . 3.6 tp -80.23 -25.7 39.46 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.737 -0.21 . . . . 0.0 111.066 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -52.77 144.75 13.62 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.288 0.566 . . . . 0.0 111.667 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -53.38 -33.36 53.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.603 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.73 -41.0 85.4 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.91 0.386 . . . . 0.0 110.446 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -71.34 -45.23 63.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.88 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.478 HG22 HD13 ' A' ' 129' ' ' LEU . 42.7 mt -61.32 -49.09 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.954 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.95 -33.52 70.72 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.284 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.6 t -79.23 -43.95 22.78 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -63.07 -45.67 91.06 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.169 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.714 HD21 ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -68.28 -23.81 64.8 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.665 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 20.4 tttm -50.88 -42.91 59.42 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.613 0.244 . . . . 0.0 111.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.02 -66.55 0.88 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.477 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 51.79 34.01 12.34 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.719 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 161.0 53.3 0.02 OUTLIER Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.623 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -92.84 -126.17 4.02 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.232 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -143.81 23.85 1.71 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.5 0.191 . . . . 0.0 111.502 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 50.63 31.85 6.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.524 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.16 -56.39 2.65 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.898 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -79.6 142.35 35.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.976 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -114.15 -35.66 4.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.449 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.7 14.65 9.87 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.904 0.383 . . . . 0.0 111.634 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 3.9 m -144.61 41.48 1.33 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.608 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.949 -179.923 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.819 0.342 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 34' ' ' SER . 28.0 m -78.08 101.2 6.86 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.514 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 35' ' ' THR . 9.2 mttp -95.13 169.79 9.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.822 HD12 HD12 ' A' ' 36' ' ' ILE . 3.4 tt -129.33 124.87 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.576 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.33 106.11 5.81 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.645 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -39.05 84.65 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.754 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -52.52 64.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.957 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -66.8 -52.96 37.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.293 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.2 m -53.11 -46.96 68.94 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.27 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -65.14 -41.67 94.55 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.716 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.52 75.01 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.665 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.88 99.4 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.77 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.668 ' HE2' HG13 ' A' ' 105' ' ' VAL . 4.3 t80 -59.25 -42.11 90.35 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.979 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -66.52 -41.46 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.065 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 tp -71.28 -48.27 51.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.639 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.08 -29.51 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.336 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -61.19 -34.15 74.61 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.624 0.249 . . . . 0.0 110.703 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.56 100.48 1.82 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -6.79 59.62 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.38 -32.12 62.7 Favored Glycine 0 C--N 1.338 0.661 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.876 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.6 t -87.26 175.35 8.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.922 0.391 . . . . 0.0 111.455 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.63 54.79 2.97 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.31 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.5 t -132.17 98.53 3.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.703 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -104.61 -30.93 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 30.4 p-90 -132.28 157.97 43.02 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.881 0.372 . . . . 0.0 111.582 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 0.2 OUTLIER -141.63 149.27 20.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.466 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.526 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 90.3 m -88.93 162.47 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.893 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.413 ' N ' HG22 ' A' ' 28' ' ' THR . 9.8 m-85 -148.23 96.41 2.62 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.811 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -123.67 152.56 41.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.452 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -105.56 118.07 35.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.95 0.405 . . . . 0.0 111.054 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.11 90.55 0.87 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.43 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.45 -57.52 4.12 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.491 ' O ' HG23 ' A' ' 3' ' ' THR . 1.7 t -149.66 -35.62 0.17 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 11.3 t -80.28 130.32 35.12 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.924 0.393 . . . . 0.0 111.338 -179.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.822 HD12 HD12 ' A' ' 5' ' ' ILE . 33.0 mt -79.29 141.01 15.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.08 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.542 HG23 ' HB1' ' A' ' 9' ' ' ALA . 7.5 p -158.59 138.31 8.59 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.049 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 19.4 Cg_endo -59.6 162.61 14.81 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.68 2.253 . . . . 0.0 112.378 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.526 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -131.54 -150.83 6.76 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 121.25 -0.5 . . . . 0.0 112.712 -179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.548 ' HB3' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -38.72 141.44 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.242 0.617 . . . . 0.0 112.47 -179.037 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -139.32 98.83 3.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.142 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.83 165.86 23.76 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.853 -0.689 . . . . 0.0 113.332 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.491 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -87.1 -21.92 25.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.627 0.251 . . . . 0.0 110.865 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -97.28 128.06 43.8 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.536 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -73.95 -20.13 60.46 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.652 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.521 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -48.21 -40.74 25.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.828 0.347 . . . . 0.0 110.36 179.46 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -39.38 88.23 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.263 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.569 ' HZ ' ' HB2' ' A' ' 60' ' ' ALA . 6.4 t80 -69.03 -45.22 71.02 Favored 'General case' 0 C--N 1.338 0.066 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.736 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 46' ' ' GLN . 26.7 mt -57.4 -40.54 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.324 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -68.04 -39.53 83.03 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.03 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -89.98 0.03 57.32 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.5 t -110.03 87.4 2.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.88 0.372 . . . . 0.0 111.425 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.33 176.77 5.59 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.448 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.84 19.58 1.68 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -133.07 75.68 1.64 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.714 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.21 -172.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-O 120.837 0.351 . . . . 0.0 111.813 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -166.62 96.31 0.55 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.365 179.725 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 pp -151.92 173.31 14.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.443 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -107.06 163.71 12.76 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.134 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HB2' ' HZ ' ' A' ' 48' ' ' PHE . . . -143.11 161.42 38.24 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.022 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -148.05 126.94 12.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.043 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.9 p -134.99 138.5 48.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.185 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -102.02 106.4 17.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.497 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -108.92 140.0 43.0 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.994 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.466 HG23 ' C ' ' A' ' 73' ' ' ARG . 42.4 m -139.39 133.78 31.53 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.928 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.7 p -113.3 89.41 3.07 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.821 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.435 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.29 169.39 36.11 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.845 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -159.87 79.42 0.7 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 111.115 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 45.99 34.86 2.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.522 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.0 ptt? -152.24 -37.61 0.11 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.389 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.6 t -158.08 85.93 0.89 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.236 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.435 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -79.69 105.27 10.86 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.041 -179.51 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.466 ' C ' HG23 ' A' ' 65' ' ' THR . 0.6 OUTLIER -103.47 88.27 3.06 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.834 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 p -91.98 135.23 34.11 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.139 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -146.54 146.23 30.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.4 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 34.2 m-85 -99.95 130.79 46.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.417 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.596 ' HB2' HD12 ' A' ' 129' ' ' LEU . . . -122.75 127.03 48.65 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.292 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.0 tt -100.94 107.2 18.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.382 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.586 ' CG2' HD12 ' A' ' 114' ' ' ILE . 3.1 mt -99.83 105.03 16.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.503 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.9 p -88.95 116.53 27.31 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.847 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.418 ' HZ3' HG22 ' A' ' 114' ' ' ILE . 74.9 t-105 -100.25 140.57 34.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.078 0.465 . . . . 0.0 111.82 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 mt -144.57 101.2 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.653 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.33 124.52 9.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.261 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -33.07 -46.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 -179.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.722 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.0 m-80 -56.05 -10.92 0.92 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -51.98 125.68 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.929 0.395 . . . . 0.0 110.998 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.09 162.84 28.58 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.64 -50.7 52.61 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.813 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.29 -39.51 87.16 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.772 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.481 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 71.6 mm-40 -61.95 -44.58 96.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.531 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -57.06 -48.12 79.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.743 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.41 -44.72 89.16 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.647 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -56.58 -54.58 44.28 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.291 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 m -48.74 -40.17 27.61 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.489 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -58.26 -52.37 53.0 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.963 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.719 ' O ' HG22 ' A' ' 99' ' ' THR . 0.6 OUTLIER -62.5 -37.48 86.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.305 . . . . 0.0 110.786 179.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.481 ' O ' HG23 ' A' ' 101' ' ' VAL . 22.6 m-20 -70.06 -35.7 74.42 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.195 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -31.79 71.94 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.299 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 96' ' ' THR . 7.0 t -81.02 -33.33 33.68 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.951 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.449 ' O ' HG23 ' A' ' 104' ' ' VAL . 36.0 mt -64.22 -43.81 93.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 97' ' ' ASP . 39.6 t -68.02 -42.53 85.38 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.04 -37.41 76.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.0 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.12 -42.51 93.87 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.761 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 100' ' ' LEU . 43.4 t -69.58 -41.34 80.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.909 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.668 HG13 ' HE2' ' A' ' 14' ' ' TYR . 36.3 t -114.1 97.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.949 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -96.18 -22.24 17.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.567 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.6 80.44 5.98 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.965 0.412 . . . . 0.0 110.514 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 12.5 p90 -129.27 172.91 11.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.734 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -117.34 -53.95 2.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.531 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.1 125.57 13.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.776 0.322 . . . . 0.0 111.494 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -125.43 128.35 47.95 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.557 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.408 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 4.4 p90 -144.1 161.75 38.01 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.987 0.422 . . . . 0.0 111.514 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 15.6 t -100.81 141.99 16.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.392 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.586 HD12 ' CG2' ' A' ' 79' ' ' ILE . 31.7 mt -135.94 135.78 50.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.623 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 21.3 t -118.58 -15.98 9.51 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.991 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -115.0 151.89 33.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 111.03 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -21.96 66.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.354 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -55.8 22.11 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.576 0.227 . . . . 0.0 110.792 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.475 ' HG3' ' CZ ' ' A' ' 124' ' ' PHE . 0.6 OUTLIER -73.88 -30.03 62.4 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.072 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.542 ' N ' HG21 ' A' ' 114' ' ' ILE . 0.9 OUTLIER -68.72 -25.85 64.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.689 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.04 136.98 56.32 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -53.21 -29.94 34.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.924 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -59.91 -47.16 86.92 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.945 0.402 . . . . 0.0 110.425 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.475 ' CZ ' ' HG3' ' A' ' 119' ' ' GLU . 30.8 t80 -68.21 -48.36 65.42 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.862 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.408 HG23 ' HZ ' ' A' ' 112' ' ' PHE . 59.6 mt -54.61 -43.74 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -43.29 80.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.179 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -47.54 76.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.819 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.63 -42.83 97.7 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.118 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.596 HD12 ' HB2' ' A' ' 77' ' ' ALA . 5.2 tt -70.23 -31.97 69.63 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.249 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -60.63 3.3 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.738 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.3 mtpt -99.24 -53.43 3.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 60.66 33.09 20.36 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.664 0.269 . . . . 0.0 111.379 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.05 55.88 0.25 Allowed Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.629 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.49 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . -178.18 173.18 45.7 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 121.215 -0.517 . . . . 0.0 112.395 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 76.34 18.58 1.82 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 111.627 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -152.72 24.24 0.59 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.821 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -65.17 -57.42 8.6 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.542 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -100.02 156.87 16.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.873 0.368 . . . . 0.0 111.269 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -103.42 -25.85 13.11 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.091 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -91.62 10.85 26.39 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 34.1 m -118.49 -39.05 3.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.095 -0.955 . . . . 0.0 111.126 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.694 0.283 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.4 t -128.4 147.31 50.64 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.638 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' O ' ' HA ' ' A' ' 35' ' ' THR . 12.2 mttp -99.51 151.42 21.17 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.065 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.511 HG13 ' HB ' ' A' ' 36' ' ' ILE . 3.8 tt -116.71 128.96 73.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.37 106.67 16.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -58.57 -37.34 75.54 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.215 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.27 -49.81 76.41 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.912 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.86 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -63.56 -53.89 44.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.307 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' HG11 ' A' ' 104' ' ' VAL . 1.7 t -53.54 -43.04 68.09 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.187 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -68.78 -43.07 76.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.935 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.64 -45.97 73.86 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.69 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.697 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -64.52 -48.39 75.29 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.84 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -53.39 -46.57 69.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.855 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -57.52 -43.52 84.36 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.019 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.28 -40.84 81.72 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.077 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.697 HG23 ' O ' ' A' ' 13' ' ' ALA . 42.8 t -64.69 -42.01 93.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.842 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.6 -41.27 80.9 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.631 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -70.68 124.35 24.07 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.641 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -99.81 30.44 3.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.492 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -136.51 32.39 2.48 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.759 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.631 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -130.96 24.55 4.96 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.852 0.326 . . . . 0.0 111.776 -179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . 54.75 28.7 10.57 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 22' ' ' SER . 42.9 t -124.89 114.31 39.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 111.22 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.466 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pp -107.41 -30.16 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.434 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -131.27 154.87 48.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.878 0.371 . . . . 0.0 111.173 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.514 ' CG1' HG22 ' A' ' 17' ' ' VAL . 34.2 m -142.17 146.77 22.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.261 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.22 170.71 9.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.995 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -148.56 98.96 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.36 179.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.26 -179.57 3.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.013 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 35.2 p90 -140.8 128.56 21.67 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.023 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.44 ' O ' HG22 ' A' ' 35' ' ' THR . 1.1 t70 -96.9 107.16 19.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.397 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.59 -77.56 1.07 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.161 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.72 38.31 0.47 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.753 0.311 . . . . 0.0 111.359 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.44 HG22 ' O ' ' A' ' 32' ' ' ASP . 2.6 t -140.77 122.73 15.52 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.898 0.38 . . . . 0.0 110.987 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.511 ' HB ' HG13 ' A' ' 5' ' ' ILE . 4.0 mm -79.47 133.44 29.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.94 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.564 HG23 ' HB1' ' A' ' 9' ' ' ALA . 9.8 p -157.09 139.0 10.11 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.005 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.86 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 15.6 Cg_endo -56.34 162.75 7.39 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.61 2.207 . . . . 0.0 112.329 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -127.06 -157.96 9.66 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.387 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.5 mp0 -32.63 139.11 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.782 0.833 . . . . 0.0 112.611 -179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.464 ' HB3' HG11 ' A' ' 24' ' ' VAL . 22.3 mt-30 -136.4 91.78 2.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.408 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.18 168.5 21.44 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 113.317 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.466 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -94.21 -15.23 24.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.754 -0.223 . . . . 0.0 111.187 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -96.72 129.61 44.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -78.42 -17.09 56.88 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.717 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -49.76 -40.57 41.61 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.765 0.317 . . . . 0.0 110.601 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -66.91 -36.17 81.65 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.928 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.525 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 8.1 t80 -60.7 -46.7 89.38 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.761 0.315 . . . . 0.0 110.788 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 25.1 mt -63.94 -41.47 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -70.42 -40.05 74.07 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.715 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.16 -42.01 69.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.535 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -73.71 81.91 1.57 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.921 0.391 . . . . 0.0 111.265 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 p -117.4 155.83 28.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.56 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.479 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 7.2 m-20 -72.33 69.53 0.81 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.203 0.525 . . . . 0.0 110.95 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.734 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.5 t70 -170.03 46.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.098 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.668 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.66 -171.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.885 0.374 . . . . 0.0 111.935 -178.457 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.755 ' HB3' HG12 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -160.99 94.51 1.02 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.565 179.686 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.59 177.11 11.58 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.849 0.357 . . . . 0.0 111.675 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.741 ' CD2' HG23 ' A' ' 80' ' ' THR . 28.7 m-85 -109.74 163.43 13.51 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.462 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.525 ' HB1' ' CE2' ' A' ' 48' ' ' PHE . . . -147.42 141.48 26.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.084 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.537 ' HE1' HD12 ' A' ' 78' ' ' LEU . 1.5 t80 -122.39 135.42 54.69 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.021 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -137.24 136.17 47.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.179 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -101.76 127.1 48.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.826 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -107.56 151.22 25.89 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.184 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.73 128.43 20.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.0 p -141.72 131.23 23.85 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.447 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -153.61 137.85 5.98 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.169 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -133.5 137.58 45.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.5 -0.35 . . . . 0.0 110.248 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 70' ' ' MET . . . 61.68 30.6 18.56 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.234 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 0.7 OUTLIER 83.74 1.45 0.98 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.435 179.768 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.435 ' O ' ' HA2' ' A' ' 67' ' ' GLY . 0.3 OUTLIER -95.12 83.46 3.92 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.89 0.376 . . . . 0.0 110.75 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.447 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 2.2 ttpm? -86.0 140.5 30.25 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.299 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -145.97 114.84 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.551 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.42 151.76 23.75 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.695 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -137.9 144.03 41.12 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.891 0.377 . . . . 0.0 111.402 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.563 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 3.6 m-85 -94.0 134.99 35.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.795 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -135.95 106.27 6.41 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.892 0.377 . . . . 0.0 111.429 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.537 HD12 ' HE1' ' A' ' 61' ' ' PHE . 7.7 tt -96.35 117.05 30.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.41 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.413 HG21 ' CD2' ' A' ' 120' ' ' LEU . 2.1 mp -118.87 119.94 62.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 120.878 0.37 . . . . 0.0 111.345 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.741 HG23 ' CD2' ' A' ' 59' ' ' PHE . 1.5 m -88.08 138.58 31.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.235 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.668 ' CE3' HD12 ' A' ' 120' ' ' LEU . 52.5 t-105 -115.54 125.98 53.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.912 0.387 . . . . 0.0 111.192 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.668 HG13 HG11 ' A' ' 86' ' ' VAL . 3.3 tt -123.59 81.4 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.523 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.546 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -62.48 126.05 36.89 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.572 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -29.62 -34.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.734 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 2.7 m-80 -73.93 39.64 0.11 Allowed 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.755 HG12 ' HB3' ' A' ' 57' ' ' ARG . 4.7 m -96.46 112.08 27.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.505 178.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.9 170.15 16.8 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.154 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -46.03 -50.65 12.04 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.493 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.67 -35.94 81.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.625 0.212 . . . . 0.0 111.513 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.465 ' HG3' ' HG3' ' A' ' 57' ' ' ARG . 3.0 mp0 -65.09 -39.93 93.87 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.997 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -50.68 -50.42 54.88 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.837 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.22 -38.58 68.96 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -55.33 -40.68 71.48 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.366 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.5 m -53.26 -46.91 69.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.151 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -62.06 -50.4 65.78 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.001 -0.618 . . . . 0.0 112.624 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.5 p -62.66 -41.22 98.94 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.562 0.22 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -66.64 -40.87 88.9 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.09 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -30.21 68.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.772 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 28.5 m -71.9 -42.68 66.46 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.774 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 74.1 mt -56.52 -56.07 25.88 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.19 -36.55 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.963 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.62 -45.1 89.94 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.907 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.07 -38.05 84.86 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.554 HG11 ' SG ' ' A' ' 10' ' ' CYS . 20.3 t -73.74 -43.54 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.35 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.89 100.25 10.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.926 0.393 . . . . 0.0 111.118 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -103.47 -29.34 11.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.573 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.78 83.81 4.9 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.14 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -138.19 -179.14 5.61 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.736 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -109.6 -67.19 1.0 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.387 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -134.87 144.57 47.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -134.41 137.05 43.74 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.868 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.582 ' HZ ' HG23 ' A' ' 125' ' ' ILE . 8.7 p90 -155.66 173.98 15.95 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.101 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.535 HG23 ' HB ' ' A' ' 80' ' ' THR . 9.9 p -124.41 141.01 45.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.404 HD12 ' HB3' ' A' ' 119' ' ' GLU . 30.8 mm -126.22 153.37 34.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.15 -179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 3.4 m -117.59 -24.74 7.16 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -117.81 146.81 43.58 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.941 0.4 . . . . 0.0 111.168 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -62.57 -28.04 69.6 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.594 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.87 -45.76 91.47 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.667 0.27 . . . . 0.0 110.886 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.404 ' HB3' HD12 ' A' ' 114' ' ' ILE . 1.8 mt-10 -77.55 -31.5 53.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.8 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.841 HD23 HD11 ' A' ' 125' ' ' ILE . 0.4 OUTLIER -79.76 -2.23 42.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.732 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.07 132.23 53.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.931 0.396 . . . . 0.0 110.523 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.39 -37.76 49.93 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.609 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.5 -43.1 99.46 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.28 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -67.94 -51.54 46.43 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.834 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.841 HD11 HD23 ' A' ' 120' ' ' LEU . 63.7 mt -57.71 -50.44 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -55.05 -42.09 72.27 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.185 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -40.69 94.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.045 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -63.14 -56.8 13.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.577 HD23 HG22 ' A' ' 125' ' ' ILE . 2.8 pp -63.81 -23.54 67.4 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.609 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -82.47 -29.38 30.62 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.421 0.153 . . . . 0.0 110.911 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.41 -55.22 4.44 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -131.98 44.51 2.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.88 0.371 . . . . 0.0 111.531 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -120.68 30.29 5.58 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.44 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -154.69 -101.62 0.2 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.505 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -166.15 41.16 0.06 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.653 0.264 . . . . 0.0 111.398 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 46.76 44.38 14.0 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.941 0.401 . . . . 0.0 111.229 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -65.89 -49.76 66.91 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.225 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -95.46 148.76 22.13 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.028 0.442 . . . . 0.0 111.134 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -147.15 -66.42 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.706 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -141.56 18.19 2.19 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.552 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 13.0 t -121.85 37.98 4.23 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.324 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.355 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.77 0.319 . . . . 0.0 111.282 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 t -136.29 143.66 44.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.694 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -179.55 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.565 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.567 ' HB ' HD12 ' A' ' 36' ' ' ILE . 2.5 tt -130.72 133.32 63.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.747 0.308 . . . . 0.0 111.16 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -83.13 96.17 8.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.37 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -59.83 -42.92 94.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.244 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.98 -49.81 74.62 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.323 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.429 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -70.27 -50.94 34.49 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 40.8 m -55.35 -42.9 74.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -66.11 -47.23 74.85 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.516 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.28 -44.19 71.68 Favored 'General case' 0 CA--C 1.527 0.06 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.894 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.528 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -66.62 -37.48 84.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.252 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -55.13 -60.07 3.89 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.15 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -63.96 -29.48 70.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.526 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.947 HD23 HG11 ' A' ' 24' ' ' VAL . 4.0 tt -62.55 -44.54 96.07 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 120.714 0.293 . . . . 0.0 110.603 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 13' ' ' ALA . 52.3 t -68.2 -34.63 67.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.58 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -60.3 -35.99 76.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.72 123.59 25.2 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.412 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.02 41.99 1.11 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.321 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.26 24.16 3.11 Favored Glycine 0 CA--C 1.521 0.458 0 C-N-CA 120.841 -0.695 . . . . 0.0 113.153 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.46 27.32 2.81 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 117.053 0.427 . . . . 0.0 111.74 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . 48.08 34.96 4.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.485 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.947 HG11 HD23 ' A' ' 16' ' ' LEU . 14.2 p -118.34 117.77 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.519 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.684 HD12 HG13 ' A' ' 62' ' ' VAL . 1.1 pt -121.57 -31.56 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.538 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 32.2 p-90 -130.87 158.42 40.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.951 0.405 . . . . 0.0 111.384 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.769 HG12 ' HG2' ' A' ' 41' ' ' GLN . 14.5 m -144.52 145.18 21.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.23 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.495 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 16.7 p -105.7 100.23 9.8 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.812 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' A' ' 59' ' ' PHE . 3.8 m-85 -78.89 109.62 13.34 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.666 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -128.45 135.58 49.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.593 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -91.69 123.7 35.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.989 0.423 . . . . 0.0 111.244 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.98 123.33 45.69 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.715 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.1 -83.04 0.74 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.357 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -151.94 31.06 0.56 Allowed 'General case' 0 C--O 1.233 0.223 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.5 t -149.82 139.22 21.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.744 0.307 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.567 HD12 ' HB ' ' A' ' 5' ' ' ILE . 7.0 mt -85.09 137.77 20.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.901 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.415 HG23 ' CB ' ' A' ' 9' ' ' ALA . 10.0 p -155.15 141.26 12.96 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.499 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.439 ' HG3' ' CZ ' ' A' ' 29' ' ' PHE . 37.8 Cg_exo -57.56 154.34 36.92 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.555 2.17 . . . . 0.0 112.515 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -128.45 -155.74 8.75 Favored Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 121.325 -0.464 . . . . 0.0 112.082 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.5 mp0 -24.52 130.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.727 0.811 . . . . 0.0 112.643 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.769 ' HG2' HG12 ' A' ' 27' ' ' VAL . 13.9 mt-30 -131.69 98.13 4.4 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.32 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.85 164.33 24.98 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.482 -0.866 . . . . 0.0 113.32 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.596 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -89.67 -20.66 23.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.62 0.248 . . . . 0.0 110.889 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.81 126.49 37.91 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.795 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 12.9 t80 -70.79 -19.13 62.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.671 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -46.98 -41.94 17.12 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.745 0.307 . . . . 0.0 110.643 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -66.89 -36.68 82.83 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.937 178.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -58.68 -49.34 77.93 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.099 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.3 mt -70.85 -42.61 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.22 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.67 -45.43 94.16 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.027 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mm-40 -76.39 -31.01 57.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.8 m -75.29 84.55 2.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.056 0.455 . . . . 0.0 111.5 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p -93.17 169.67 10.22 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.15 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -85.46 17.43 3.19 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.721 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -133.67 67.86 1.51 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.296 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.721 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -177.35 -172.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.386 -179.096 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.746 ' HD3' HG12 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -159.06 114.91 2.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.778 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 pp -158.31 154.06 26.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.827 0.346 . . . . 0.0 111.537 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 1.5 m-85 -107.05 98.98 8.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.407 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -107.92 157.41 18.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.767 ' HB3' HD23 ' A' ' 78' ' ' LEU . 31.7 p90 -152.37 164.29 37.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.262 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.684 HG13 HD12 ' A' ' 25' ' ' ILE . 4.4 t -137.41 152.54 27.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.364 -179.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -113.26 104.11 12.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.633 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -103.7 173.33 6.35 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.44 114.05 19.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.274 179.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -89.18 91.55 8.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.425 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.6 178.26 36.68 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.784 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -159.7 79.45 0.71 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.896 0.379 . . . . 0.0 111.247 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 42.68 39.58 1.69 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.499 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.57 -36.18 0.06 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.611 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.5 m -156.58 81.75 0.96 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.819 0.342 . . . . 0.0 110.947 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.425 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 14.8 pttm -83.51 102.06 11.86 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.844 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -105.56 133.29 50.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.63 135.68 33.69 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.839 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.426 ' HD3' ' HB1' ' A' ' 109' ' ' ALA . 24.5 mttm -151.73 146.33 25.68 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.953 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.595 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 76.1 m-85 -92.98 170.68 9.48 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.116 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.666 ' HB2' ' CD1' ' A' ' 129' ' ' LEU . . . -154.87 105.54 2.58 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.055 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.767 HD23 ' HB3' ' A' ' 61' ' ' PHE . 7.4 mt -80.99 134.64 35.73 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.203 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.514 ' CG2' HD12 ' A' ' 114' ' ' ILE . 21.4 mt -129.8 105.43 12.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.027 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.864 ' HB ' HG12 ' A' ' 113' ' ' VAL . 0.3 OUTLIER -80.23 97.04 6.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.208 179.601 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.41 ' CZ3' HD12 ' A' ' 120' ' ' LEU . 71.2 t-105 -89.22 135.03 33.79 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 41.4 mt -141.58 101.4 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.78 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.68 ' O ' HG13 ' A' ' 86' ' ' VAL . . . -68.08 117.06 8.17 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.026 -0.606 . . . . 0.0 112.221 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' C ' ' H ' ' A' ' 86' ' ' VAL . 1.2 mt-10 -32.04 -40.3 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -179.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.709 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 3.0 m-80 -71.28 42.0 0.07 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 111.942 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.746 HG12 ' HD3' ' A' ' 57' ' ' ARG . 2.7 m -95.49 135.2 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.491 178.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.16 164.49 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.08 -44.47 83.47 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.024 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 tp -66.46 -32.14 73.32 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.622 0.211 . . . . 0.0 111.317 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -59.25 -40.21 85.25 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.959 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -40.45 80.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.18 -39.36 40.99 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -58.45 -46.32 86.79 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.011 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -42.28 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.193 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -59.43 -46.65 93.57 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.191 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.1 -43.13 68.32 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.646 0.26 . . . . 0.0 110.837 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.646 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.7 m-20 -61.6 -38.79 88.88 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.422 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.73 -30.62 70.09 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.681 0.277 . . . . 0.0 110.664 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 23.3 m -71.54 -41.82 68.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.412 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 97' ' ' ASP . 8.7 mt -63.33 -51.24 66.81 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.39 -30.58 49.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.312 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.9 ttmt -65.55 -45.12 84.61 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.638 0.256 . . . . 0.0 110.676 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -38.69 81.99 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.831 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 26.2 t -78.26 -37.04 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.971 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.9 t -129.8 83.31 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.94 0.4 . . . . 0.0 110.751 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.0 -35.63 7.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.196 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.97 77.83 2.85 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -124.73 179.39 5.0 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -92.17 -59.36 2.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.5 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.85 154.29 51.22 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.751 0.31 . . . . 0.0 111.359 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -148.88 135.6 19.7 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.174 -179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.662 ' HE2' HD11 ' A' ' 114' ' ' ILE . 13.7 p90 -160.44 159.32 30.8 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.927 0.394 . . . . 0.0 111.292 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.864 HG12 ' HB ' ' A' ' 80' ' ' THR . 2.6 m -100.3 147.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.992 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.662 HD11 ' HE2' ' A' ' 112' ' ' PHE . 59.6 mt -142.18 140.62 29.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.956 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 54.6 m -140.49 31.57 1.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.413 ' H ' HG22 ' A' ' 114' ' ' ILE . 33.1 t70 -145.8 134.57 22.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.488 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -34.06 74.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.948 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -69.08 -41.09 78.0 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.681 0.277 . . . . 0.0 110.485 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.71 -32.85 64.11 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.666 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.41 HD12 ' CZ3' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -69.12 -24.94 64.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.577 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.91 135.2 12.66 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.045 0.45 . . . . 0.0 111.336 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.421 ' HB2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -50.79 -33.74 24.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.094 -179.538 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -38.34 73.22 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 110.309 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -76.14 -46.2 29.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.714 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.497 HG21 HD11 ' A' ' 79' ' ' ILE . 29.3 mm -60.19 -51.47 72.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.225 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.0 -42.79 95.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.684 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.1 t -62.78 -43.36 99.01 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.571 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.02 -42.44 90.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.092 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.666 ' CD1' ' HB2' ' A' ' 77' ' ' ALA . 2.2 tp -64.42 -43.14 95.29 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.446 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 32.7 tttp -63.92 -46.71 83.59 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.26 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -73.55 -50.9 19.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.146 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.36 41.3 32.05 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.311 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 70.51 43.76 60.22 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.535 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -83.4 158.96 36.43 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.351 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -102.78 25.81 8.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.511 0.196 . . . . 0.0 111.2 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 50.85 47.15 25.14 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 120.909 0.385 . . . . 0.0 110.955 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -60.42 -55.97 27.14 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.522 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -86.19 159.46 19.48 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.205 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -171.47 -62.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.989 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -114.15 17.07 17.93 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.714 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 2.6 m -90.5 55.88 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.953 0.406 . . . . 0.0 110.894 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.943 179.891 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 67.32 118.59 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.142 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -88.62 150.81 22.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.072 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 tt -120.86 124.3 72.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.596 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.08 112.92 9.57 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.911 0.386 . . . . 0.0 110.806 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -72.24 -42.97 65.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.925 -179.834 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -57.06 -51.45 69.22 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.019 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.729 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -61.15 -50.78 71.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.3 t -57.35 -44.24 84.13 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.211 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -65.78 -42.0 91.31 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.35 -47.91 68.97 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.747 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.17 84.6 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.666 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -59.26 -37.58 77.95 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.124 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -69.98 -44.25 69.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.284 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.82 -46.88 67.45 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.102 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.92 -24.91 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.39 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -39.84 66.68 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.881 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.39 114.52 6.15 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.571 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -95.55 42.16 1.09 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.235 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.66 31.73 2.37 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.719 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 t -137.82 177.54 7.8 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.842 0.353 . . . . 0.0 111.1 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.34 55.03 3.32 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.04 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.547 HG11 ' CD ' ' A' ' 41' ' ' GLN . 40.2 t -142.59 125.0 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.468 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -127.01 -29.28 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.575 ' HB2' HG22 ' A' ' 62' ' ' VAL . 32.7 p-90 -132.96 157.65 44.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.952 0.406 . . . . 0.0 111.727 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.62 HG13 ' HG3' ' A' ' 41' ' ' GLN . 2.3 t -139.07 150.52 23.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.255 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.43 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 73.7 m -90.99 159.97 15.87 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.492 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -145.29 93.16 2.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.208 0.528 . . . . 0.0 110.558 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.3 pttt -113.31 179.14 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -143.78 130.32 20.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.979 0.419 . . . . 0.0 111.427 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.8 -149.54 0.1 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.271 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.4 83.17 0.06 OUTLIER Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.558 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m 65.42 49.62 1.84 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.58 0.352 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.7 t -164.07 113.44 1.21 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.138 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.443 ' O ' HG13 ' A' ' 37' ' ' VAL . 31.2 mt -85.68 139.75 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 36' ' ' ILE . 4.6 m -156.57 154.5 27.04 Favored Pre-proline 0 C--O 1.233 0.185 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.28 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.729 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 44.7 Cg_endo -67.31 166.06 24.73 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.539 2.159 . . . . 0.0 112.255 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.43 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -139.1 -147.02 5.04 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.566 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 2.7 mp0 -31.96 133.33 0.1 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.356 0.662 . . . . 0.0 112.334 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.62 ' HG3' HG13 ' A' ' 27' ' ' VAL . 1.2 tt0 -136.37 93.97 2.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -143.12 168.61 26.02 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.098 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.468 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -86.82 -19.44 28.99 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.573 0.225 . . . . 0.0 110.799 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -89.95 112.14 23.43 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -66.72 -23.1 66.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.768 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.791 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -48.7 -35.04 13.11 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.678 0.275 . . . . 0.0 110.792 179.613 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 -38.78 90.81 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.052 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.583 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 56.9 t80 -70.97 -38.9 72.77 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.576 0.227 . . . . 0.0 110.926 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.791 HD12 ' HA ' ' A' ' 46' ' ' GLN . 17.0 mt -62.93 -40.28 88.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.795 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -45.9 85.21 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.359 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -31.63 67.89 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.468 -179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.443 ' HB3' ' CD1' ' A' ' 120' ' ' LEU . 1.8 m -74.01 83.94 1.76 Allowed 'General case' 0 C--O 1.233 0.184 0 CA-C-O 120.971 0.415 . . . . 0.0 111.182 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.2 p -100.29 -176.97 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.075 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.25 18.08 2.31 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.853 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.638 ' O ' HG13 ' A' ' 56' ' ' VAL . 47.9 t0 -144.09 79.59 1.62 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.854 0.359 . . . . 0.0 110.219 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.638 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.59 -175.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.39 -179.417 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.718 ' HD2' HG23 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -171.57 77.2 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.073 0.463 . . . . 0.0 110.671 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 pp -132.38 170.95 14.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.463 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -106.2 174.88 5.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.583 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -151.48 157.76 42.74 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.255 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.402 ' CD2' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -135.3 121.09 19.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.799 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.575 HG22 ' HB2' ' A' ' 26' ' ' TRP . 16.2 t -135.77 127.24 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.102 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.16 118.45 26.58 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.471 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -106.3 154.14 21.18 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.863 0.364 . . . . 0.0 111.662 -179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 t -139.12 129.74 25.95 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.5 p -123.91 104.44 8.93 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.051 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.24 167.98 35.71 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.584 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -153.33 79.6 1.17 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.923 0.392 . . . . 0.0 111.167 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 37.91 44.47 0.61 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.639 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.4 ptt? -165.31 -37.4 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.494 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 p -152.39 87.44 1.32 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.437 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 18.3 mtmt -84.33 114.84 22.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.17 163.43 16.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.3 t -139.26 144.67 38.51 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.872 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.503 ' HE3' HD23 ' A' ' 129' ' ' LEU . 0.0 OUTLIER -143.19 150.71 39.74 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.098 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.42 ' HB2' ' HA ' ' A' ' 108' ' ' PHE . 11.6 m-85 -105.55 116.97 32.84 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.002 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.09 123.62 50.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.822 0.344 . . . . 0.0 111.428 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.442 ' HB3' ' CB ' ' A' ' 111' ' ' GLU . 3.5 tp -98.18 104.65 16.7 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.337 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.464 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 38.6 mm -85.68 100.06 8.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 113' ' ' VAL . 86.5 m -84.8 108.77 17.64 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.31 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.661 ' CE3' HD11 ' A' ' 120' ' ' LEU . 66.5 t-105 -95.29 138.78 32.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.967 0.413 . . . . 0.0 111.435 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.508 HG23 ' OG ' ' A' ' 115' ' ' SER . 2.7 tt -141.1 88.02 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.831 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.46 123.37 33.13 Favored Glycine 0 C--N 1.336 0.563 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.57 -39.83 0.52 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -178.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 4.9 m-80 -73.75 42.96 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.226 0.536 . . . . 0.0 111.549 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.718 HG23 ' HD2' ' A' ' 57' ' ' ARG . 8.1 p -96.59 135.61 30.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.766 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 m -71.33 157.87 37.34 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.89 -42.83 87.11 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.987 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mt -58.85 -43.11 90.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.638 0.256 . . . . 0.0 111.045 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.92 -33.78 76.34 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.194 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -52.74 33.57 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.975 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.47 -36.44 78.97 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 179.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -43.28 69.82 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -49.19 -46.83 46.11 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.16 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.62 -45.85 93.61 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.373 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 21.8 m -62.54 -46.57 87.79 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.71 0.29 . . . . 0.0 110.877 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.573 ' HA ' HD12 ' A' ' 100' ' ' LEU . 62.8 m-20 -61.03 -37.29 82.06 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -57.19 -34.09 68.15 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.709 0.29 . . . . 0.0 110.637 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 37.7 m -72.66 -43.39 63.23 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.624 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 97' ' ' ASP . 37.9 mt -58.31 -47.13 84.66 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 38.8 t -64.64 -38.28 82.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.873 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -38.18 90.14 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.97 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -63.74 -38.93 92.96 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.758 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 t -81.59 -42.86 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.046 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -108.75 102.72 14.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.904 0.383 . . . . 0.0 110.984 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mp0 -100.93 -28.86 12.53 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.339 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -80.57 78.7 7.28 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.006 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.42 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 26.1 p90 -133.88 160.47 37.57 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.6 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -97.94 -61.89 1.32 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.437 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.87 149.54 33.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.442 ' CB ' ' HB3' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -144.93 129.46 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.673 ' HE1' HD11 ' A' ' 114' ' ' ILE . 10.4 p90 -144.02 161.78 37.89 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.97 0.414 . . . . 0.0 111.261 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.485 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 14.5 p -101.18 140.79 19.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.034 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.673 HD11 ' HE1' ' A' ' 112' ' ' PHE . 15.9 mt -133.63 148.39 30.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.508 ' OG ' HG23 ' A' ' 82' ' ' ILE . 1.7 m -131.16 26.42 4.87 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.228 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.606 ' H ' HG22 ' A' ' 114' ' ' ILE . 24.4 t70 -134.19 138.14 44.92 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.606 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -37.06 80.96 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.006 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -43.27 99.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -69.61 -31.56 69.75 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.613 179.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.661 HD11 ' CE3' ' A' ' 81' ' ' TRP . 17.1 mt -62.25 -31.96 72.59 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.969 179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -46.17 127.62 8.83 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.087 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -49.8 -41.65 45.06 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.647 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -56.2 -42.7 77.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.96 0.409 . . . . 0.0 110.278 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -64.51 -48.82 73.72 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.854 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 31.6 mt -59.26 -45.58 92.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -44.02 72.85 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.861 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.9 t -63.07 -43.16 99.37 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.744 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -52.23 65.5 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.503 HD23 ' HE3' ' A' ' 75' ' ' LYS . 2.4 mp -61.12 -31.88 71.58 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.717 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -93.77 18.5 10.18 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt -110.96 -48.89 3.07 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.618 0.247 . . . . 0.0 110.961 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -79.59 72.81 6.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.507 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 107.32 48.92 0.89 Allowed Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.435 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -161.94 50.13 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.751 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -164.43 23.41 0.06 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -174.19 32.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.713 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -69.24 -44.54 71.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.546 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -112.04 153.39 26.94 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.018 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -171.11 34.84 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.391 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -133.1 14.85 4.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.672 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 1.9 t -158.72 -41.33 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.512 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.13 -179.959 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.921 0.391 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m -125.06 140.12 53.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.485 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -129.39 170.13 14.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.151 -179.708 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -124.48 129.38 73.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.683 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.436 ' HB2' HG12 ' A' ' 37' ' ' VAL . 4.7 m-20 -81.26 112.57 18.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.985 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.599 ' HE3' HG22 ' A' ' 104' ' ' VAL . 6.2 mptt -68.55 -40.98 80.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.753 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.52 -47.07 76.84 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.032 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.646 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -68.49 -54.15 18.73 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.266 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 m -52.86 -47.88 67.47 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.433 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.0 ttm-85 -67.46 -38.62 84.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.07 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.34 -50.31 71.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.021 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.642 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.33 -45.52 93.13 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.925 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -55.66 -44.51 77.31 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.955 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -57.44 -42.9 83.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.911 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -39.39 93.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.944 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 13' ' ' ALA . 17.7 t -64.56 -35.15 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.129 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -38.03 63.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.048 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -71.3 114.31 9.24 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.544 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -97.58 26.44 5.0 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.407 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -108.15 -29.18 4.38 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.902 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.1 t -88.6 167.28 13.51 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.888 0.375 . . . . 0.0 111.479 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.553 ' C ' ' HB2' ' A' ' 43' ' ' ALA . . . -79.7 58.43 2.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.89 107.07 5.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.948 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 HG23 ' A' ' 62' ' ' VAL . 1.1 pp -112.69 -29.58 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.742 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.419 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.8 p-90 -127.31 160.22 32.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.998 0.427 . . . . 0.0 111.391 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.905 HG13 ' HG2' ' A' ' 41' ' ' GLN . 2.6 t -139.42 149.77 22.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.414 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.469 ' HB ' ' CA ' ' A' ' 39' ' ' GLY . 60.5 m -89.01 161.92 16.32 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.401 ' N ' HG22 ' A' ' 28' ' ' THR . 15.8 m-85 -149.0 93.45 2.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.676 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 ptmm? -132.38 142.74 49.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -85.57 133.34 34.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.058 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -104.24 110.14 22.23 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.184 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.87 -71.08 2.79 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.932 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.4 p -162.36 30.52 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.585 0.231 . . . . 0.0 111.204 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 4' ' ' LYS . 37.4 p -144.33 123.95 13.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.783 0.325 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.3 mp -72.73 130.08 35.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.85 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.436 HG12 ' HB2' ' A' ' 6' ' ' ASP . 10.6 m -151.78 145.7 18.01 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.35 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.646 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 29.2 Cg_exo -62.09 168.35 9.28 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.568 2.179 . . . . 0.0 112.46 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.469 ' CA ' ' HB ' ' A' ' 28' ' ' THR . . . -140.33 -145.9 4.73 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.598 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 1.6 mp0 -34.22 137.92 0.1 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.353 0.661 . . . . 0.0 112.582 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.905 ' HG2' HG13 ' A' ' 27' ' ' VAL . 4.9 mt-30 -134.76 96.82 3.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.002 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.13 163.13 25.1 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.437 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.553 ' HB2' ' C ' ' A' ' 23' ' ' ALA . . . -86.4 -22.37 26.62 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.719 -0.241 . . . . 0.0 110.927 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -94.8 113.38 25.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.129 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -64.36 -20.1 65.9 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.627 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.8 OUTLIER -46.46 -38.59 9.37 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.704 0.287 . . . . 0.0 110.746 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -42.01 97.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.208 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.475 ' CZ ' ' HB2' ' A' ' 60' ' ' ALA . 24.3 t80 -69.07 -39.46 79.09 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.685 0.278 . . . . 0.0 110.713 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.627 HD12 ' HA ' ' A' ' 46' ' ' GLN . 25.7 mt -63.63 -34.93 70.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.067 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.29 -25.02 25.71 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.625 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.81 -25.41 26.33 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.596 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.6 p -75.07 66.76 1.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.892 0.377 . . . . 0.0 111.513 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -72.73 149.72 43.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.914 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.419 ' HB2' ' HB2' ' A' ' 84' ' ' GLU . 5.5 p-10 -80.56 56.06 2.5 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.453 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.699 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.0 OUTLIER -161.31 39.74 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.901 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.699 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -175.97 152.89 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.304 -179.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.476 ' HD2' ' HB3' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -112.6 129.71 56.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.407 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 pp -160.47 175.1 13.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.037 0.446 . . . . 0.0 111.782 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.494 ' CD1' HG23 ' A' ' 80' ' ' THR . 34.4 m-85 -111.3 178.83 4.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.924 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.734 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -145.6 159.88 42.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.033 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -149.02 118.66 6.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.835 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.457 HG23 HD12 ' A' ' 25' ' ' ILE . 14.4 p -149.97 139.4 15.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.791 0.329 . . . . 0.0 111.206 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.514 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 5.1 ptm180 -120.94 152.61 38.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.404 ' HD2' HD13 ' A' ' 129' ' ' LEU . 55.0 m-85 -139.19 150.8 45.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.055 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.0 t -131.97 128.24 38.02 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.651 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.6 p -117.08 93.59 4.25 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.998 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.449 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -160.5 172.66 36.93 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.583 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -159.88 79.53 0.7 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.123 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.25 28.79 1.07 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.577 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -146.39 -34.77 0.28 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.372 179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.22 79.78 0.68 Allowed 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.893 0.378 . . . . 0.0 110.462 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.449 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -82.04 99.42 9.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.796 -179.811 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.03 104.22 13.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.21 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.21 129.91 50.27 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmpp? -135.7 160.65 37.86 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.308 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.514 ' CD2' ' HB3' ' A' ' 63' ' ' ARG . 81.8 m-85 -112.02 163.12 14.63 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.1 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.551 ' HB2' HD12 ' A' ' 129' ' ' LEU . . . -150.92 126.58 10.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.354 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 4.6 mp -100.14 112.92 25.24 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.322 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.734 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 16.4 mt -104.11 139.6 24.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.387 -179.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.494 HG23 ' CD1' ' A' ' 59' ' ' PHE . 15.2 m -109.23 125.86 52.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.296 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -110.11 141.79 42.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.962 0.41 . . . . 0.0 111.562 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.455 HG23 HG21 ' A' ' 86' ' ' VAL . 72.4 mt -139.59 101.88 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.888 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -75.03 90.45 0.79 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 113.832 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HB2' ' HB2' ' A' ' 54' ' ' ASP . 0.5 OUTLIER 19.09 -73.15 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 178.369 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.604 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 21.1 m-80 -41.58 -26.46 0.07 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.072 0.549 . . . . 0.0 112.183 -178.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 83' ' ' GLY . 16.6 t -44.62 104.39 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.8 m -69.16 173.52 5.53 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.01 0.433 . . . . 0.0 111.909 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -57.97 -45.32 93.88 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.554 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -41.68 71.25 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.854 0.359 . . . . 0.0 110.65 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.476 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.8 mp0 -65.85 -36.34 83.19 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.542 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -46.8 81.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.485 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.35 98.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.504 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -59.06 -38.6 79.76 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.59 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 28.6 m -63.89 -39.47 94.27 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.719 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -60.89 -46.21 94.99 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.331 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -40.99 98.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.601 0.239 . . . . 0.0 110.649 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.537 ' O ' HG23 ' A' ' 101' ' ' VAL . 73.2 m-20 -65.91 -38.0 87.55 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.889 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -56.86 -33.67 67.05 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.783 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 55.5 m -74.83 -41.39 59.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.432 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.545 ' O ' HG23 ' A' ' 104' ' ' VAL . 25.3 mt -61.76 -46.06 91.22 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.016 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 97' ' ' ASP . 23.3 t -66.14 -40.87 88.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.769 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -57.2 -42.38 81.15 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.194 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -65.32 -41.13 94.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.718 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.599 HG22 ' HE3' ' A' ' 7' ' ' LYS . 38.2 t -70.44 -48.86 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.977 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -113.21 107.27 22.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.891 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -107.77 -22.44 12.47 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.853 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -75.69 79.43 2.65 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.827 0.346 . . . . 0.0 111.379 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.417 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 29.0 p90 -143.37 159.7 41.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.723 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -87.48 -58.86 2.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.162 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.6 pttp -150.18 172.63 15.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.275 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 10.3 pt-20 -153.93 150.44 28.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.226 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.509 ' HE1' HD11 ' A' ' 114' ' ' ILE . 8.8 p90 -160.18 165.99 30.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.229 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.4 p -108.39 145.34 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.251 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.568 HG22 ' H ' ' A' ' 116' ' ' ASP . 40.9 mt -135.17 146.46 30.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.692 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.7 p -138.4 29.03 2.45 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.297 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.568 ' H ' HG22 ' A' ' 114' ' ' ILE . 22.3 t70 -144.0 135.25 25.66 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.663 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -38.39 81.62 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -65.53 -46.76 78.31 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.703 0.287 . . . . 0.0 110.758 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -69.37 -30.33 68.3 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.476 ' HA ' HD23 ' A' ' 120' ' ' LEU . 0.8 OUTLIER -71.76 -23.09 61.53 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.411 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -48.22 138.44 9.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.169 0.509 . . . . 0.0 111.795 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -36.69 34.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.054 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -55.57 -39.76 71.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.922 0.392 . . . . 0.0 110.488 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -71.25 -46.3 61.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.087 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mt -61.94 -47.9 91.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.191 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.35 -38.33 90.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.246 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.7 t -67.54 -43.48 80.63 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.554 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -64.52 -45.13 88.56 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.106 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' A' ' 77' ' ' ALA . 0.9 OUTLIER -62.18 -34.1 75.78 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.33 179.906 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.67 -29.45 65.78 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.387 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.18 -76.85 0.46 Allowed 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.106 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 55.74 60.47 3.28 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -107.46 -49.26 0.87 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.768 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -78.05 74.56 2.0 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.809 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -172.76 26.91 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -165.5 26.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.264 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -60.51 -62.8 1.6 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.425 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -128.44 -165.74 1.54 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.073 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 66.36 26.93 10.13 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.713 0.292 . . . . 0.0 111.436 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -138.86 16.73 2.67 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 77.2 p -136.15 -49.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.719 179.795 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.848 0.356 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.78 104.25 12.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.778 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -111.24 176.87 4.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.821 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tt -134.22 128.47 52.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.027 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -81.5 94.73 6.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 1.4 mttm -60.99 -45.31 95.3 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.268 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -54.39 -44.99 72.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.094 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.522 ' HB1' HG23 ' A' ' 37' ' ' VAL . . . -73.15 -50.47 22.49 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.365 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.6 m -56.11 -43.69 78.39 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.28 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -69.68 -46.47 65.99 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.44 -43.83 62.15 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.69 0.281 . . . . 0.0 111.155 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -73.35 -36.4 66.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.605 ' CE1' HG13 ' A' ' 105' ' ' VAL . 12.5 t80 -58.82 -55.86 29.63 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.897 -179.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -67.53 -31.66 71.91 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.84 -49.77 55.59 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.654 0.264 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.716 HG21 HG11 ' A' ' 27' ' ' VAL . 44.6 t -69.0 -23.79 27.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -52.5 -36.74 55.88 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -75.64 120.1 20.58 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.285 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -91.92 40.08 1.03 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.527 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -146.84 34.65 1.33 Allowed Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.944 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.63 32.79 3.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.784 0.292 . . . . 0.0 111.528 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 55.01 29.59 12.62 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 24' ' ' VAL . 11.2 p -125.71 118.21 51.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.875 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 43' ' ' ALA . 1.1 pt -119.63 -33.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.475 ' CH2' ' HB3' ' A' ' 40' ' ' GLU . 37.7 p-90 -131.77 157.68 43.19 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.963 0.411 . . . . 0.0 111.041 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.716 HG11 HG21 ' A' ' 17' ' ' VAL . 17.4 m -145.83 151.99 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.52 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.533 ' HB ' ' HA3' ' A' ' 39' ' ' GLY . 40.1 m -90.5 162.06 15.22 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.709 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -146.61 91.22 2.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.173 0.511 . . . . 0.0 110.461 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.91 165.54 14.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.912 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.568 ' HB3' HD13 ' A' ' 36' ' ' ILE . 48.8 p90 -103.13 123.18 46.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.06 0.457 . . . . 0.0 111.279 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.33 114.8 24.82 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.12 38.62 59.28 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.094 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.5 p 69.28 22.39 6.67 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.708 0.403 . . . . 0.0 111.758 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.7 p -136.58 130.46 32.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 0.0 111.24 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.568 HD13 ' HB3' ' A' ' 31' ' ' TYR . 23.4 mm -68.93 130.26 33.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.983 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.522 HG23 ' HB1' ' A' ' 9' ' ' ALA . 5.4 p -150.87 138.77 12.4 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.916 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.51 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 49.3 Cg_exo -55.98 162.47 7.1 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.493 2.129 . . . . 0.0 112.579 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.533 ' HA3' ' HB ' ' A' ' 28' ' ' THR . . . -133.05 -149.29 6.12 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.596 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.49 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 4.2 mp0 -37.08 137.51 0.34 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.322 0.649 . . . . 0.0 112.605 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' CG ' HG12 ' A' ' 27' ' ' VAL . 30.9 mt-30 -136.91 103.03 5.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.169 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -142.27 164.52 26.9 Favored Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.268 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -82.23 -22.64 35.76 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.675 0.274 . . . . 0.0 110.844 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -94.92 110.51 22.39 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -66.86 -19.07 65.67 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.67 -37.76 29.96 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.687 0.28 . . . . 0.0 110.674 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -36.42 83.93 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.483 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.492 ' CE1' ' HB2' ' A' ' 60' ' ' ALA . 61.4 t80 -67.47 -52.13 42.98 Favored 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.842 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.7 mt -59.09 -35.08 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.188 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -66.3 -47.03 74.92 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.315 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.73 -42.62 50.12 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.374 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.745 ' SG ' HD11 ' A' ' 58' ' ' LEU . 4.5 m -77.02 80.55 3.55 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 111.15 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.4 p -108.82 173.09 6.47 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.77 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.612 ' HB3' ' HB2' ' A' ' 84' ' ' GLU . 12.4 m-20 -75.2 69.05 2.02 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.029 0.442 . . . . 0.0 111.284 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.679 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.3 t70 -178.55 47.7 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.329 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.679 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -177.26 -175.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.914 -179.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.48 113.08 3.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.698 0.285 . . . . 0.0 111.224 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.745 HD11 ' SG ' ' A' ' 52' ' ' CYS . 3.4 pp -160.61 170.91 19.89 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.9 0.381 . . . . 0.0 111.637 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -105.65 179.36 4.29 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.722 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -160.0 172.64 17.17 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.814 0.34 . . . . 0.0 111.576 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.488 ' CE2' HG11 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -148.33 133.91 18.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.183 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.442 HG22 ' HB2' ' A' ' 26' ' ' TRP . 15.6 t -143.74 133.25 20.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.21 112.43 25.1 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.485 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -98.26 146.94 25.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.952 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.1 m -146.24 97.04 2.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.763 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.9 p -98.98 143.06 29.7 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.501 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.496 ' CA ' ' HA ' ' A' ' 72' ' ' LYS . . . -148.54 139.12 7.39 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.464 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -124.15 130.63 52.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.439 -0.38 . . . . 0.0 110.026 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.401 ' O ' ' HG2' ' A' ' 70' ' ' MET . . . 61.47 31.72 18.97 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.5 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER 84.84 -1.53 0.9 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.298 0.639 . . . . 0.0 112.305 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.8 m -95.24 85.91 4.41 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.788 0.327 . . . . 0.0 110.688 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.496 ' HA ' ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -96.2 148.57 22.58 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.565 -179.577 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.7 ttp180 -139.57 126.23 20.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.358 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.8 t -86.96 148.26 25.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.189 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -146.05 129.64 16.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.805 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.442 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 13.2 m-85 -85.5 126.7 34.04 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.595 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.21 129.33 39.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.479 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.435 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -96.44 141.84 29.25 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.218 179.556 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.629 HG23 HD12 ' A' ' 114' ' ' ILE . 27.2 mt -125.35 122.16 62.13 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.128 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.513 ' HB ' HG12 ' A' ' 113' ' ' VAL . 7.3 m -104.92 105.9 16.15 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.11 179.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -88.98 121.93 31.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.93 0.395 . . . . 0.0 111.523 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.659 HD11 HG21 ' A' ' 86' ' ' VAL . 4.2 tt -111.38 100.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.706 178.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.506 ' HA3' ' H ' ' A' ' 56' ' ' VAL . . . -67.97 83.8 0.17 Allowed Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.825 -0.625 . . . . 0.0 114.109 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.612 ' HB2' ' HB3' ' A' ' 54' ' ' ASP . 2.3 mm-40 19.6 -81.34 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 178.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.423 ' OD1' ' HA ' ' A' ' 55' ' ' ASP . 5.6 p30 -66.51 30.83 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -177.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.659 HG21 HD11 ' A' ' 82' ' ' ILE . 3.0 m -64.3 112.58 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 161.46 0.5 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.92 -48.63 57.4 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.484 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.55 -33.27 72.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.696 0.284 . . . . 0.0 110.947 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -70.88 -44.78 65.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.314 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -57.69 -47.95 80.92 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.813 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.6 -39.3 93.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.892 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.13 -39.42 86.21 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.063 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -40.8 71.11 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.546 0.212 . . . . 0.0 110.656 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.14 -50.27 57.91 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.595 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.03 -45.84 83.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.87 0.335 . . . . 0.0 110.894 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.532 ' HA ' HD12 ' A' ' 100' ' ' LEU . 74.0 m-20 -60.71 -36.95 80.09 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.262 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -59.44 -33.25 71.04 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.577 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.8 m -68.8 -44.53 73.37 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.454 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 97' ' ' ASP . 12.3 mt -61.77 -45.72 92.67 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 97' ' ' ASP . 38.7 t -65.06 -33.1 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.889 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.71 -32.59 73.99 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.19 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.77 -55.06 10.89 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.823 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.558 HG23 HG23 ' A' ' 105' ' ' VAL . 6.9 m -63.28 -33.89 63.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.614 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.605 HG13 ' CE1' ' A' ' 14' ' ' TYR . 42.1 t -108.82 101.46 12.59 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.496 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -104.3 -33.68 8.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.621 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -78.95 73.19 5.49 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 16.2 p90 -126.5 156.68 40.35 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.972 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.25 -49.07 4.84 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.277 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.13 141.15 6.73 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.022 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.435 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 14.1 pt-20 -135.44 149.99 49.73 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -159.9 159.84 32.85 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.707 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.513 HG12 ' HB ' ' A' ' 80' ' ' THR . 11.7 m -89.43 153.09 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.979 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.629 HD12 HG23 ' A' ' 79' ' ' ILE . 60.8 mt -136.88 131.48 46.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.886 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -125.57 33.02 5.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.257 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.452 ' H ' HG22 ' A' ' 114' ' ' ILE . 9.7 p-10 -166.86 153.53 8.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.088 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.2 ptt85 -68.58 -24.61 64.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.872 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -63.57 -56.94 12.01 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.67 0.271 . . . . 0.0 110.849 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.467 ' HB2' HG23 ' A' ' 114' ' ' ILE . 37.7 mt-10 -72.17 -24.43 61.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.353 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.57 ' HA ' HD13 ' A' ' 114' ' ' ILE . 2.4 tp -74.33 -25.07 59.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.614 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -52.51 130.76 32.68 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.069 0.461 . . . . 0.0 111.069 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.776 ' HA ' HD12 ' A' ' 125' ' ' ILE . 41.4 tt0 -51.1 -40.6 58.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.899 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -62.04 -41.74 98.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.897 0.38 . . . . 0.0 110.442 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -63.2 -48.72 77.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.089 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 122' ' ' GLU . 6.9 mt -56.65 -48.07 81.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.007 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.79 -44.98 78.28 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.098 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -39.44 91.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.878 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -59.63 -53.31 59.57 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.018 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.7 pp -69.84 -24.79 63.5 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.744 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -56.54 -52.32 65.22 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 111.12 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -81.89 -38.66 24.99 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 54.55 48.95 19.27 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 115.69 -54.19 0.59 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.528 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 109.57 111.54 3.41 Favored Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.221 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -168.72 24.71 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -160.06 25.17 0.17 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.7 0.286 . . . . 0.0 111.329 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -59.82 -41.8 92.1 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.486 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -68.04 168.38 12.07 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.797 0.332 . . . . 0.0 110.944 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 64.04 27.59 14.22 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.595 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.47 14.34 16.64 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.898 0.38 . . . . 0.0 111.29 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 38.2 p -134.08 -54.44 0.86 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.718 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.405 -0.807 . . . . 0.0 111.045 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.654 0.264 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 p -117.19 123.19 46.07 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.797 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -85.25 145.97 27.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.5 tt -115.76 125.55 72.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 7.6 t0 -81.97 109.36 16.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.555 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -69.1 -36.89 78.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -69.97 -47.83 60.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.802 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -56.67 -54.1 50.06 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.888 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.4 m -59.74 -39.0 83.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.129 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -60.1 -54.36 46.88 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.44 76.91 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.233 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.75 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -61.9 -49.12 77.48 Favored 'General case' 0 C--N 1.334 -0.072 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.19 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -55.15 -46.28 75.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.507 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 66.6 m-20 -65.49 -26.91 68.13 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.437 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 tp -80.55 -38.54 29.39 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.058 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.75 HG23 ' O ' ' A' ' 13' ' ' ALA . 8.4 t -70.33 -38.31 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.94 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' A' ' 15' ' ' ASN . 5.5 ptt180 -61.86 -28.19 69.32 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.15 179.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -68.86 120.83 15.4 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.588 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.96 27.45 3.58 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.478 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -107.84 -35.14 2.64 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.648 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.68 164.68 14.61 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.89 0.345 . . . . 0.0 111.303 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.91 58.9 3.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.06 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.0 t -133.25 119.77 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.076 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.574 HG12 ' HA ' ' A' ' 43' ' ' ALA . 30.4 pt -120.69 -40.21 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.509 ' CZ3' HG23 ' A' ' 28' ' ' THR . 37.1 p-90 -122.91 158.43 30.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.872 0.367 . . . . 0.0 111.477 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 40' ' ' GLU . 19.4 m -140.55 143.67 28.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.935 179.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.509 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 3.2 p -102.28 97.29 7.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.994 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB3' ' A' ' 38' ' ' PRO . 6.0 m-85 -79.45 114.66 18.56 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.938 0.399 . . . . 0.0 110.611 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.16 162.17 34.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.695 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.427 ' HA ' ' O ' ' A' ' 35' ' ' THR . 38.7 p90 -111.04 121.61 45.79 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.039 0.447 . . . . 0.0 111.579 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.16 107.01 18.9 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.103 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.33 -78.71 1.42 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.278 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.4 m -151.65 33.97 0.55 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.601 0.239 . . . . 0.0 111.211 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.427 ' O ' ' HA ' ' A' ' 31' ' ' TYR . 2.6 t -144.7 123.8 12.87 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 7.0 mt -84.88 126.08 40.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.158 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.493 HG12 ' CB ' ' A' ' 9' ' ' ALA . 5.9 m -148.6 156.91 41.88 Favored Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.519 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.802 ' HD2' ' HB1' ' A' ' 9' ' ' ALA . 37.0 Cg_endo -65.71 156.68 62.67 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.657 2.238 . . . . 0.0 112.295 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -131.41 -154.42 7.81 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.327 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.556 ' O ' ' HA ' ' A' ' 27' ' ' VAL . 14.7 mp0 -27.59 132.69 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.681 0.792 . . . . 0.0 112.16 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.487 ' HG2' HG12 ' A' ' 27' ' ' VAL . 20.7 mt-30 -134.18 97.16 3.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.188 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -129.72 164.95 22.39 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.571 -0.823 . . . . 0.0 113.263 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 25' ' ' ILE . . . -92.33 -17.28 24.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.743 -0.228 . . . . 0.0 111.055 179.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -92.65 129.49 38.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.673 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.506 ' CD2' ' HB2' ' A' ' 122' ' ' GLU . 23.8 t80 -77.89 -15.5 58.97 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -48.27 -41.64 28.41 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.721 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.59 -38.27 80.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.733 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.463 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 4.0 t80 -57.99 -45.78 86.24 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.08 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 47.7 mt -65.51 -46.18 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.995 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.97 -38.62 91.75 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.95 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 -30.93 58.79 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.73 74.57 3.39 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.808 0.337 . . . . 0.0 111.565 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -100.52 144.38 29.58 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.645 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.541 ' HA ' ' HA2' ' A' ' 83' ' ' GLY . 5.2 p-10 -76.05 64.96 2.0 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 111.642 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.756 ' HA ' ' HB2' ' A' ' 85' ' ' ASN . 1.7 t0 -168.44 44.71 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.97 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 55' ' ' ASP . 0.0 OUTLIER 174.66 -176.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.516 HH11 HG23 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -140.21 112.86 8.01 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.447 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.89 139.54 26.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.946 0.403 . . . . 0.0 111.466 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.479 ' CD2' HG22 ' A' ' 80' ' ' THR . 52.5 m-85 -85.69 141.53 29.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.105 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.463 ' HB1' ' CE2' ' A' ' 48' ' ' PHE . . . -160.26 113.33 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.809 0.338 . . . . 0.0 111.202 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.409 ' HB2' ' HA ' ' A' ' 78' ' ' LEU . 16.8 p90 -116.08 156.13 26.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.723 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -137.75 149.81 25.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.085 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -107.75 112.43 25.09 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.705 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -111.58 137.61 49.2 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.0 t -93.44 131.78 38.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.511 179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.3 p -134.64 116.76 15.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.624 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.521 ' HA3' ' HA ' ' A' ' 72' ' ' LYS . . . -148.31 142.44 10.02 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.605 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.1 79.6 1.92 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.145 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 30.91 55.97 0.22 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.426 0.631 . . . . 0.0 112.334 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.76 -46.92 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.425 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.6 m -153.9 84.61 1.15 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.935 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.521 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 2.3 ptpp? -97.67 120.08 37.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.488 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -159.56 168.07 27.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.429 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.97 139.49 37.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -118.41 141.69 48.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.608 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.602 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 0.9 OUTLIER -100.79 138.8 37.36 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.771 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.767 ' CB ' HD11 ' A' ' 129' ' ' LEU . . . -147.32 119.82 8.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.329 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HB2' ' HB3' ' A' ' 111' ' ' GLU . 2.3 mp -92.87 118.6 31.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.546 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.92 100.02 9.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 111.081 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.543 ' OG1' HG22 ' A' ' 113' ' ' VAL . 0.2 OUTLIER -80.06 120.97 24.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.403 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -98.96 130.28 45.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.194 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.492 ' O ' HG23 ' A' ' 82' ' ' ILE . 2.7 tt -129.99 96.43 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.104 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.541 ' HA2' ' HA ' ' A' ' 54' ' ' ASP . . . -69.27 108.79 2.6 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.805 179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' C ' ' H ' ' A' ' 86' ' ' VAL . 3.7 mm-40 -34.39 -38.97 0.07 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.756 ' HB2' ' HA ' ' A' ' 55' ' ' ASP . 5.6 m-80 -73.15 43.29 0.12 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.391 0.615 . . . . 0.0 111.382 -179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.516 HG23 HH11 ' A' ' 57' ' ' ARG . 8.6 p -100.94 136.02 34.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.347 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 m -66.55 155.09 38.68 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.18 42.89 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.183 -0.532 . . . . 0.0 113.061 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt -56.89 -43.66 81.51 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.631 0.253 . . . . 0.0 110.922 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.59 -39.04 92.44 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.799 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -49.21 69.57 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.099 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.49 95.12 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.947 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -57.5 -41.95 81.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.85 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.7 m -59.09 -43.95 91.88 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.842 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.7 67.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.091 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.8 m -67.6 -37.9 83.22 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.565 0.221 . . . . 0.0 110.7 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.571 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 t70 -57.77 -41.95 83.08 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -30.37 68.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.278 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 38.7 m -70.79 -42.69 70.01 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.794 0.33 . . . . 0.0 110.747 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 97' ' ' ASP . 11.2 mt -62.92 -50.93 68.89 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.06 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.434 ' HA ' HG12 ' A' ' 104' ' ' VAL . 14.3 p -59.7 -30.2 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.049 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -67.35 -39.52 85.77 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.793 0.33 . . . . 0.0 110.617 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.74 -35.01 79.18 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.994 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.802 HG13 HG23 ' A' ' 105' ' ' VAL . 14.8 p -87.06 -31.5 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.634 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.802 HG23 HG13 ' A' ' 104' ' ' VAL . 40.8 t -113.38 97.71 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.846 0.355 . . . . 0.0 110.894 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.45 -34.32 6.56 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.689 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.75 84.1 2.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.987 0.422 . . . . 0.0 110.83 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -138.06 164.95 27.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.806 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 76' ' ' PHE . . . -98.95 -48.05 5.03 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' ALA . 1.9 ttmt -156.55 139.31 15.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.821 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 78' ' ' LEU . 9.1 pt-20 -135.86 135.25 39.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -151.56 159.5 44.08 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.104 0.478 . . . . 0.0 111.534 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.543 HG22 ' OG1' ' A' ' 80' ' ' THR . 11.4 t -103.94 139.72 24.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.373 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 113' ' ' VAL . 47.5 mm -134.86 149.16 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.069 0.461 . . . . 0.0 111.489 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 8.6 t -119.05 -25.75 6.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.493 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.405 ' HB3' ' HB2' ' A' ' 119' ' ' GLU . 38.1 t70 -88.68 146.22 25.19 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.925 0.393 . . . . 0.0 110.895 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.748 ' HA ' HD12 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -69.37 -29.76 67.61 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.668 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.4 -32.96 43.11 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.243 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.445 ' HA ' ' CD2' ' A' ' 124' ' ' PHE . 0.5 OUTLIER -75.4 -29.28 59.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.621 -179.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.808 HD22 ' O ' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -95.9 -13.47 23.91 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.763 ' N ' HD13 ' A' ' 120' ' ' LEU . 0.7 OUTLIER -53.74 153.27 4.65 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 121.145 0.498 . . . . 0.0 111.592 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.691 ' HA ' HD12 ' A' ' 125' ' ' ILE . 1.8 tt0 -54.66 -37.54 65.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.895 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -42.1 93.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.84 0.353 . . . . 0.0 110.207 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.445 ' CD2' ' HA ' ' A' ' 119' ' ' GLU . 12.2 t80 -70.41 -41.8 72.49 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.0 179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 122' ' ' GLU . 23.8 mt -61.24 -57.58 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.125 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -38.2 74.47 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.415 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.9 t -70.41 -48.64 55.16 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.994 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.14 -44.88 94.29 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.653 0.263 . . . . 0.0 111.074 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.767 HD11 ' CB ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -59.89 -37.38 79.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.577 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.7 tttp -85.13 -59.06 2.44 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 111.639 0.236 . . . . 0.0 111.639 -179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -70.74 -52.88 17.99 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.421 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 58.91 34.26 23.54 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.55 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.519 ' HA3' ' CD2' ' A' ' 137' ' ' TYR . . . 57.77 41.48 93.97 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.815 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.549 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . -91.03 73.34 1.76 Allowed Glycine 0 C--N 1.336 0.576 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.516 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 80.07 19.96 0.59 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.887 0.375 . . . . 0.0 111.206 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.86 28.44 0.22 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.765 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.519 ' CD2' ' HA3' ' A' ' 133' ' ' GLY . 1.8 t80 -51.81 -62.89 1.34 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.202 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -120.1 148.65 43.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.952 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -176.1 34.18 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.155 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -114.96 12.96 16.92 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.584 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 6.1 t -153.5 -45.57 0.09 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.836 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.843 179.657 . . . . . . . . 0 0 . 1 stop_ save_